N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide

C17H27N3O — CID 61276033

IUPACN-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESCC(C)CC(CNC(=O)c1ccc2c(c1)CCN2)N(C)C
InChIInChI=1S/C17H27N3O/c1-12(2)9-15(20(3)4)11-19-17(21)14-5-6-16-13(10-14)7-8-18-16/h5-6,10,12,15,18H,7-9,11H2,1-4H3,(H,19,21)
InChIKeyLQZVATDULHIHHW-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.36
Rot. Bonds6

About N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide

N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 61276033) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID61276033
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC NameN-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide
SMILESCC(C)CC(CNC(=O)c1ccc2c(c1)CCN2)N(C)C
InChIInChI=1S/C17H27N3O/c1-12(2)9-15(20(3)4)11-19-17(21)14-5-6-16-13(10-14)7-8-18-16/h5-6,10,12,15,18H,7-9,11H2,1-4H3,(H,19,21)
InChIKeyLQZVATDULHIHHW-UHFFFAOYSA-N
XLogP2.36
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-2-hydroxypropyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 93083353
N-[2-[di(propan-2-yl)amino]ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 43325545
N-[2-(dimethylamino)-2-methylpropyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 61247768
N-[2-[ethyl(methyl)amino]ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 62641149
N-(2-hydroxy-2,4-dimethylpentyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 66171666
N-(2-acetamidoethyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43552874
N-(4-hydroxybutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 83177553
N-pentyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142455
N-(3-methoxy-2-methylpropyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 55118425
N-[(2,2,3,3-tetramethylcyclopropyl)methyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 79362938
N-ethyl-N-(2-methylpropyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43273795
N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 60937969

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide (CID 61276033) is N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide is CC(C)CC(CNC(=O)c1ccc2c(c1)CCN2)N(C)C.
What is the InChIKey of N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is LQZVATDULHIHHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-12(2)9-15(20(3)4)11-19-17(21)14-5-6-16-13(10-14)7-8-18-16/h5-6,10,12,15,18H,7-9,11H2,1-4H3,(H,19,21).
What are the key properties of N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide?
N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 289.42 g/mol, XLogP of 2.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-4-methylpentyl]-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 61276033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).