N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide

C24H29N5O3 — CID 174909338

IUPACN-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide
SMILESO=C(NCCC1CNCCO1)c1ccc2c(-c3ccc(C4CNCCO4)nc3)c[nH]c2c1
InChIInChI=1S/C24H29N5O3/c30-24(27-6-5-18-13-25-7-9-31-18)16-1-3-19-20(14-29-22(19)11-16)17-2-4-21(28-12-17)23-15-26-8-10-32-23/h1-4,11-12,14,18,23,25-26,29H,5-10,13,15H2,(H,27,30)
InChIKeyRZUMVSWTWONCMN-UHFFFAOYSA-N
MW435.53 g/mol
LogP2.00
Rot. Bonds6

About N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide

N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide (PubChem CID 174909338) has the molecular formula C24H29N5O3 and a molecular weight of 435.53 g/mol. Its IUPAC name is N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide
PubChem CID174909338
Molecular FormulaC24H29N5O3
Molecular Weight435.53 g/mol
Exact Mass435.23
IUPAC NameN-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide
SMILESO=C(NCCC1CNCCO1)c1ccc2c(-c3ccc(C4CNCCO4)nc3)c[nH]c2c1
InChIInChI=1S/C24H29N5O3/c30-24(27-6-5-18-13-25-7-9-31-18)16-1-3-19-20(14-29-22(19)11-16)17-2-4-21(28-12-17)23-15-26-8-10-32-23/h1-4,11-12,14,18,23,25-26,29H,5-10,13,15H2,(H,27,30)
InChIKeyRZUMVSWTWONCMN-UHFFFAOYSA-N
XLogP2.00
TPSA100.30 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.53
LogP ≤ 52.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide?
The IUPAC name of N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide (CID 174909338) is N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide.
What is the SMILES notation for N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide?
The canonical SMILES for N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide is O=C(NCCC1CNCCO1)c1ccc2c(-c3ccc(C4CNCCO4)nc3)c[nH]c2c1.
What is the InChIKey of N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide?
The InChIKey is RZUMVSWTWONCMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O3/c30-24(27-6-5-18-13-25-7-9-31-18)16-1-3-19-20(14-29-22(19)11-16)17-2-4-21(28-12-17)23-15-26-8-10-32-23/h1-4,11-12,14,18,23,25-26,29H,5-10,13,15H2,(H,27,30).
What are the key properties of N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide?
N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide has a molecular weight of 435.53 g/mol, XLogP of 2.00, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-2-ylethyl)-3-(6-morpholin-2-yl-3-pyridinyl)-1H-indole-6-carboxamide is sourced from PubChem (CID 174909338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).