N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide

C17H24N2O — CID 81385612

IUPACN-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESC[C@@H](NC(=O)c1ccc2c(c1)CCN2)C1CCCCC1
InChIInChI=1S/C17H24N2O/c1-12(13-5-3-2-4-6-13)19-17(20)15-7-8-16-14(11-15)9-10-18-16/h7-8,11-13,18H,2-6,9-10H2,1H3,(H,19,20)/t12-/m1/s1
InChIKeyOPIHBSXOPZVCFK-GFCCVEGCSA-N
MW272.39 g/mol
LogP3.35
Rot. Bonds3

About N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide

N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 81385612) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID81385612
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESC[C@@H](NC(=O)c1ccc2c(c1)CCN2)C1CCCCC1
InChIInChI=1S/C17H24N2O/c1-12(13-5-3-2-4-6-13)19-17(20)15-7-8-16-14(11-15)9-10-18-16/h7-8,11-13,18H,2-6,9-10H2,1H3,(H,19,20)/t12-/m1/s1
InChIKeyOPIHBSXOPZVCFK-GFCCVEGCSA-N
XLogP3.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-cyclohexylethyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 81389029
N-[1-(oxan-4-yl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 104938337
N-[1-(oxolan-2-yl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 43533899
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 43325579
N-cyclopropyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142413
methyl 2-(2,3-dihydro-1H-indole-5-carbonylamino)propanoate
CID 60780386
N-(4-hydroxybutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 83177553
N-[(1S)-1-cyclohexylethyl]-4-[4-[[(1S)-1-cyclohexylethyl]carbamoyl]phenyl]benzamide
CID 132596984
2-oxo-N-(1-piperidin-3-ylethyl)-3,4-dihydro-1H-quinoline-6-carboxamide;hydrochloride
CID 119474020
3-amino-4-chloro-N-[(1R)-1-cycloheptylethyl]benzamide
CID 81392061
4-amino-3-bromo-N-[(1R)-1-cycloheptylethyl]benzamide
CID 81392320
(2S)-2-(1,2,3,4-tetrahydroquinoline-6-carbonylamino)propanoic acid
CID 78967710

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide (CID 81385612) is N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide is C[C@@H](NC(=O)c1ccc2c(c1)CCN2)C1CCCCC1.
What is the InChIKey of N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is OPIHBSXOPZVCFK-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H24N2O/c1-12(13-5-3-2-4-6-13)19-17(20)15-7-8-16-14(11-15)9-10-18-16/h7-8,11-13,18H,2-6,9-10H2,1H3,(H,19,20)/t12-/m1/s1.
What are the key properties of N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide?
N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 272.39 g/mol, XLogP of 3.35, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 81385612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).