6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide

C56H56F6N8O3 — CID 158782988

IUPAC6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide
SMILESCC(C)c1c(C(=O)NCc2ccc(C(F)(F)F)nc2)c2ccc(OC3CCCC3)cc2n1Cc1ccccn1.Cc1ccc2c(C(=O)NCc3ccc(C(F)(F)F)nc3)c(C(C)C)n(Cc3ccccn3)c2c1
InChIInChI=1S/C30H31F3N4O2.C26H25F3N4O/c1-19(2)28-27(29(38)36-17-20-10-13-26(35-16-20)30(31,32)33)24-12-11-23(39-22-8-3-4-9-22)15-25(24)37(28)18-21-7-5-6-14-34-21;1-16(2)24-23(25(34)32-14-18-8-10-22(31-13-18)26(27,28)29)20-9-7-17(3)12-21(20)33(24)15-19-6-4-5-11-30-19/h5-7,10-16,19,22H,3-4,8-9,17-18H2,1-2H3,(H,36,38);4-13,16H,14-15H2,1-3H3,(H,32,34)
InChIKeyIRHZIOBAYQCEHY-UHFFFAOYSA-N
MW1003.10 g/mol
LogP12.73
Rot. Bonds14

About 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide

6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide (PubChem CID 158782988) has the molecular formula C56H56F6N8O3 and a molecular weight of 1003.10 g/mol. Its IUPAC name is 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide.

Molecular Properties

Compound Name6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide
PubChem CID158782988
Molecular FormulaC56H56F6N8O3
Molecular Weight1003.10 g/mol
Exact Mass1002.44
IUPAC Name6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide
SMILESCC(C)c1c(C(=O)NCc2ccc(C(F)(F)F)nc2)c2ccc(OC3CCCC3)cc2n1Cc1ccccn1.Cc1ccc2c(C(=O)NCc3ccc(C(F)(F)F)nc3)c(C(C)C)n(Cc3ccccn3)c2c1
InChIInChI=1S/C30H31F3N4O2.C26H25F3N4O/c1-19(2)28-27(29(38)36-17-20-10-13-26(35-16-20)30(31,32)33)24-12-11-23(39-22-8-3-4-9-22)15-25(24)37(28)18-21-7-5-6-14-34-21;1-16(2)24-23(25(34)32-14-18-8-10-22(31-13-18)26(27,28)29)20-9-7-17(3)12-21(20)33(24)15-19-6-4-5-11-30-19/h5-7,10-16,19,22H,3-4,8-9,17-18H2,1-2H3,(H,36,38);4-13,16H,14-15H2,1-3H3,(H,32,34)
InChIKeyIRHZIOBAYQCEHY-UHFFFAOYSA-N
XLogP12.73
TPSA128.85 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds14
Heavy Atoms73
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001003.10
LogP ≤ 512.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-[(3,4-difluorophenyl)methyl]-2-propan-2-yl-6-propan-2-yloxy-1-(pyridin-2-ylmethyl)indole-3-carboxamide
CID 44159280
1-methyl-N-[1-[(4-piperidin-4-yloxyphenyl)methyl]-3,4-dihydro-2H-quinolin-8-yl]indole-3-carboxamide
CID 162650740
1-Benzyl-6-(cyclopentoxy)-N-(3,4-difluorobenzyl)-2-isopropyl-1H-indole-3-carboxamide
CID 25160863
N-[(3,4-difluorophenyl)methyl]-6-(oxolan-2-yloxy)-2-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxamide
CID 44233255
6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-(pyridin-3-ylmethyl)indole-3-carboxamide
CID 44233257
6-(2-methylpropoxy)-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-(pyridin-3-ylmethyl)indole-3-carboxamide
CID 44233258
6-cyclopentyloxy-N-[(3,4-difluorophenyl)methyl]-2-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxamide
CID 44234003
N-[(3,4-difluorophenyl)methyl]-6-(2-methoxyethoxy)-2-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxamide
CID 44234004
N-[(3,4-difluorophenyl)methyl]-6-(oxolan-3-yloxy)-2-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxamide
CID 44234005
N-[(3,4-difluorophenyl)methyl]-2-propan-2-yl-6-prop-2-ynoxy-1-(pyridin-2-ylmethyl)indole-3-carboxamide
CID 44234006
N-[(3,4-difluorophenyl)methyl]-6-(2-methylpropoxy)-2-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxamide
CID 44234256
N-[(3,4-difluorophenyl)methyl]-2-propan-2-yl-6-propoxy-1-(pyridin-2-ylmethyl)indole-3-carboxamide
CID 44234257

Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide?
The IUPAC name of 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide (CID 158782988) is 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide.
What is the SMILES notation for 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide?
The canonical SMILES for 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide is CC(C)c1c(C(=O)NCc2ccc(C(F)(F)F)nc2)c2ccc(OC3CCCC3)cc2n1Cc1ccccn1.Cc1ccc2c(C(=O)NCc3ccc(C(F)(F)F)nc3)c(C(C)C)n(Cc3ccccn3)c2c1.
What is the InChIKey of 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide?
The InChIKey is IRHZIOBAYQCEHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H31F3N4O2.C26H25F3N4O/c1-19(2)28-27(29(38)36-17-20-10-13-26(35-16-20)30(31,32)33)24-12-11-23(39-22-8-3-4-9-22)15-25(24)37(28)18-21-7-5-6-14-34-21;1-16(2)24-23(25(34)32-14-18-8-10-22(31-13-18)26(27,28)29)20-9-7-17(3)12-21(20)33(24)15-19-6-4-5-11-30-19/h5-7,10-16,19,22H,3-4,8-9,17-18H2,1-2H3,(H,36,38);4-13,16H,14-15H2,1-3H3,(H,32,34).
What are the key properties of 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide?
6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide has a molecular weight of 1003.10 g/mol, XLogP of 12.73, 14 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyloxy-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide;6-methyl-2-propan-2-yl-1-(pyridin-2-ylmethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indole-3-carboxamide is sourced from PubChem (CID 158782988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).