N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide

C16H19N3O2 — CID 61043628

IUPACN-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide
SMILESNC(=O)C1CCC(NC(=O)c2cccc3[nH]ccc23)CC1
InChIInChI=1S/C16H19N3O2/c17-15(20)10-4-6-11(7-5-10)19-16(21)13-2-1-3-14-12(13)8-9-18-14/h1-3,8-11,18H,4-7H2,(H2,17,20)(H,19,21)
InChIKeySXRIJQHNLPQSSN-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.94
Rot. Bonds3

About N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide

N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide (PubChem CID 61043628) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide
PubChem CID61043628
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide
SMILESNC(=O)C1CCC(NC(=O)c2cccc3[nH]ccc23)CC1
InChIInChI=1S/C16H19N3O2/c17-15(20)10-4-6-11(7-5-10)19-16(21)13-2-1-3-14-12(13)8-9-18-14/h1-3,8-11,18H,4-7H2,(H2,17,20)(H,19,21)
InChIKeySXRIJQHNLPQSSN-UHFFFAOYSA-N
XLogP1.94
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-1H-indole-4-carboxamide
CID 43582325
N-(azepan-4-yl)-1H-indole-4-carboxamide
CID 107172324
N-piperidin-3-yl-1H-indole-4-carboxamide
CID 63321491
N-[(3R)-piperidin-3-yl]-1H-indole-4-carboxamide
CID 104645556
N-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]-1H-indole-4-carboxamide
CID 20872294
N-[4-[[2,6-bis(trifluoromethyl)-4-pyridinyl]amino]cyclohexyl]-1H-indole-4-carboxamide
CID 166008900
N-(2-aminocycloheptyl)-1H-indole-4-carboxamide
CID 63257895
N-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)-1H-indole-4-carboxamide
CID 91132074
N-(2-hydroxycyclohexyl)-1H-indole-4-carboxamide
CID 62366462
N-[3-(cyclopropylamino)propyl]-1H-indole-4-carboxamide
CID 43596537
N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide
CID 43594493
1H-indole-4-carbohydrazide
CID 43316644

Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide?
The IUPAC name of N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide (CID 61043628) is N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide.
What is the SMILES notation for N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide?
The canonical SMILES for N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide is NC(=O)C1CCC(NC(=O)c2cccc3[nH]ccc23)CC1.
What is the InChIKey of N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide?
The InChIKey is SXRIJQHNLPQSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c17-15(20)10-4-6-11(7-5-10)19-16(21)13-2-1-3-14-12(13)8-9-18-14/h1-3,8-11,18H,4-7H2,(H2,17,20)(H,19,21).
What are the key properties of N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide?
N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.94, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide is sourced from PubChem (CID 61043628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).