N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide

C27H30N6O2 — CID 25190407

IUPACN-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide
SMILESCOc1ccc(C(CNC(=O)c2cn(-c3ncccn3)c3cccc(C)c23)N2CCCCC2)cn1
InChIInChI=1S/C27H30N6O2/c1-19-8-6-9-22-25(19)21(18-33(22)27-28-12-7-13-29-27)26(34)31-17-23(32-14-4-3-5-15-32)20-10-11-24(35-2)30-16-20/h6-13,16,18,23H,3-5,14-15,17H2,1-2H3,(H,31,34)
InChIKeyUYOZVFBAAGNPAH-UHFFFAOYSA-N
MW470.58 g/mol
LogP4.09
Rot. Bonds7

About N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide

N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide (PubChem CID 25190407) has the molecular formula C27H30N6O2 and a molecular weight of 470.58 g/mol. Its IUPAC name is N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide
PubChem CID25190407
Molecular FormulaC27H30N6O2
Molecular Weight470.58 g/mol
Exact Mass470.24
IUPAC NameN-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide
SMILESCOc1ccc(C(CNC(=O)c2cn(-c3ncccn3)c3cccc(C)c23)N2CCCCC2)cn1
InChIInChI=1S/C27H30N6O2/c1-19-8-6-9-22-25(19)21(18-33(22)27-28-12-7-13-29-27)26(34)31-17-23(32-14-4-3-5-15-32)20-10-11-24(35-2)30-16-20/h6-13,16,18,23H,3-5,14-15,17H2,1-2H3,(H,31,34)
InChIKeyUYOZVFBAAGNPAH-UHFFFAOYSA-N
XLogP4.09
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.58
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide with MolForge

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Related Compounds

N-[2-(4-fluorophenyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide
CID 69012733
4-methyl-N-(3-methyl-2-piperidin-1-ylhexa-3,5-dienyl)-1-pyrimidin-2-ylindole-3-carboxamide
CID 123805184
N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-2,3-dimethylbenzamide
CID 35047300
4-chloro-N-[2-(5-fluoro-3-pyridinyl)-2-morpholin-4-ylethyl]-1-pyrimidin-2-ylindole-3-carboxamide
CID 69083928
N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2,3-dimethylbenzamide
CID 43007764
5-methoxy-2-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 146042975
N-[[1-(4-chlorophenyl)cyclohexyl]methyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide
CID 25190235
N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-2-(dimethylamino)pyridine-3-carboxamide
CID 110301839
N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]quinoline-8-carboxamide
CID 30695715
N-[2-(azepan-1-yl)-2-phenylethyl]-3-methylpyridine-4-carboxamide
CID 131940299
N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]pyridine-2-carboxamide
CID 46522817
4-chloro-N-[4-methyl-2-(4-propan-2-ylpiperazin-1-yl)pentyl]-1-pyrimidin-2-ylindole-3-carboxamide
CID 69082923

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide?
The IUPAC name of N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide (CID 25190407) is N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide.
What is the SMILES notation for N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide?
The canonical SMILES for N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide is COc1ccc(C(CNC(=O)c2cn(-c3ncccn3)c3cccc(C)c23)N2CCCCC2)cn1.
What is the InChIKey of N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide?
The InChIKey is UYOZVFBAAGNPAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30N6O2/c1-19-8-6-9-22-25(19)21(18-33(22)27-28-12-7-13-29-27)26(34)31-17-23(32-14-4-3-5-15-32)20-10-11-24(35-2)30-16-20/h6-13,16,18,23H,3-5,14-15,17H2,1-2H3,(H,31,34).
What are the key properties of N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide?
N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide has a molecular weight of 470.58 g/mol, XLogP of 4.09, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methoxy-3-pyridinyl)-2-piperidin-1-ylethyl]-4-methyl-1-pyrimidin-2-ylindole-3-carboxamide is sourced from PubChem (CID 25190407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).