N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide

C16H20N2O — CID 61060523

IUPACN-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C16H20N2O/c1-2-9-18(11-12-3-4-12)16(19)14-6-5-13-7-8-17-15(13)10-14/h5-8,10,12,17H,2-4,9,11H2,1H3
InChIKeyROZNJHQWYMIQMI-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.43
Rot. Bonds5

About N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide

N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide (PubChem CID 61060523) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide
PubChem CID61060523
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C16H20N2O/c1-2-9-18(11-12-3-4-12)16(19)14-6-5-13-7-8-17-15(13)10-14/h5-8,10,12,17H,2-4,9,11H2,1H3
InChIKeyROZNJHQWYMIQMI-UHFFFAOYSA-N
XLogP3.43
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(cyclopropylmethyl)-N-propyl-3-sulfanylbenzamide
CID 107024680
3-chloro-N-(cyclopropylmethyl)-4-hydroxy-N-propylbenzamide
CID 60654225
N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-1H-indole-6-carboxamide
CID 63373207
N-piperidin-3-yl-N-propyl-1H-indole-6-carboxamide
CID 63748800
4-chloro-N-(cyclopropylmethyl)-3-methylsulfonyl-N-propylbenzamide
CID 78785868
N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide
CID 60654196
4-methoxy-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79702846
N-(cyclopropylmethyl)-3-fluoro-4-nitro-N-propylbenzamide
CID 62680227
N-(cyclopropylmethyl)-N-propylfuran-3-carboxamide
CID 86912308
N-chloro-N-methyl-1H-indole-6-carboxamide
CID 156761567
4-iodo-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79721151
3-(benzylsulfamoyl)-N-(cyclopropylmethyl)-4-methyl-N-propylbenzamide
CID 30948744

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide (CID 61060523) is N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide is CCCN(CC1CC1)C(=O)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide?
The InChIKey is ROZNJHQWYMIQMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-2-9-18(11-12-3-4-12)16(19)14-6-5-13-7-8-17-15(13)10-14/h5-8,10,12,17H,2-4,9,11H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide?
N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide is sourced from PubChem (CID 61060523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).