N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide

C22H26N4O — CID 109204779

IUPACN-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(NCCc2c[nH]c3ccccc23)ccn1
InChIInChI=1S/C22H26N4O/c27-22(26-17-6-2-1-3-7-17)21-14-18(11-13-24-21)23-12-10-16-15-25-20-9-5-4-8-19(16)20/h4-5,8-9,11,13-15,17,25H,1-3,6-7,10,12H2,(H,23,24)(H,26,27)
InChIKeyNWZFGZFCUPFWLN-UHFFFAOYSA-N
MW362.48 g/mol
LogP4.28
Rot. Bonds6

About N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide

N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide (PubChem CID 109204779) has the molecular formula C22H26N4O and a molecular weight of 362.48 g/mol. Its IUPAC name is N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
PubChem CID109204779
Molecular FormulaC22H26N4O
Molecular Weight362.48 g/mol
Exact Mass362.21
IUPAC NameN-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(NCCc2c[nH]c3ccccc23)ccn1
InChIInChI=1S/C22H26N4O/c27-22(26-17-6-2-1-3-7-17)21-14-18(11-13-24-21)23-12-10-16-15-25-20-9-5-4-8-19(16)20/h4-5,8-9,11,13-15,17,25H,1-3,6-7,10,12H2,(H,23,24)(H,26,27)
InChIKeyNWZFGZFCUPFWLN-UHFFFAOYSA-N
XLogP4.28
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 54.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109204033
N-cyclohexyl-6-[2-(1H-indol-3-yl)ethylamino]pyrimidine-4-carboxamide
CID 109342013
N-(3,5-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109215354
N-cyclopropyl-2-[2-(1H-indol-3-yl)ethylamino]pyrimidine-4-carboxamide
CID 109295766
N-cyclopentyl-6-[2-(1H-indol-3-yl)ethylamino]-2-methylpyrimidine-4-carboxamide
CID 109363292
N,N-diethyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109215333
N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109215351
N-cyclopropyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109223605
4-[[(2R)-2-hydroxypropyl]amino]-N-[2-(1H-indol-3-yl)ethyl]pyridine-2-carboxamide
CID 95556692
4-(tert-butylamino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-2-carboxamide
CID 109215296
N-cyclooctyl-2-[2-(1H-indol-3-yl)ethylamino]acetamide
CID 50955220
2-(cyclohexylamino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-4-carboxamide
CID 109166332

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
The IUPAC name of N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide (CID 109204779) is N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide is O=C(NC1CCCCC1)c1cc(NCCc2c[nH]c3ccccc23)ccn1.
What is the InChIKey of N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
The InChIKey is NWZFGZFCUPFWLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O/c27-22(26-17-6-2-1-3-7-17)21-14-18(11-13-24-21)23-12-10-16-15-25-20-9-5-4-8-19(16)20/h4-5,8-9,11,13-15,17,25H,1-3,6-7,10,12H2,(H,23,24)(H,26,27).
What are the key properties of N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide has a molecular weight of 362.48 g/mol, XLogP of 4.28, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109204779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).