N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide

C19H19N3O — CID 113084830

IUPACN-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide
SMILESCN(CC1(c2c[nH]c3ccccc23)CC1)C(=O)c1cccnc1
InChIInChI=1S/C19H19N3O/c1-22(18(23)14-5-4-10-20-11-14)13-19(8-9-19)16-12-21-17-7-3-2-6-15(16)17/h2-7,10-12,21H,8-9,13H2,1H3
InChIKeyIFEKHYJJWHLVPJ-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.37
Rot. Bonds4

About N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide

N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide (PubChem CID 113084830) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide
PubChem CID113084830
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC NameN-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide
SMILESCN(CC1(c2c[nH]c3ccccc23)CC1)C(=O)c1cccnc1
InChIInChI=1S/C19H19N3O/c1-22(18(23)14-5-4-10-20-11-14)13-19(8-9-19)16-12-21-17-7-3-2-6-15(16)17/h2-7,10-12,21H,8-9,13H2,1H3
InChIKeyIFEKHYJJWHLVPJ-UHFFFAOYSA-N
XLogP3.37
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]pyridine-3-carboxamide
CID 113084707
N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]benzamide
CID 113084670
N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]butanamide
CID 113084659
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-1H-indole-3-carboxamide
CID 105420068
4-(dimethylsulfamoyl)-N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]benzamide
CID 113084702
N-(chloromethyl)-N-methylpyridine-3-carboxamide
CID 141227221
N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-3-methylbutanamide
CID 113084663
N-(2-hydroxy-2-methylpropyl)-N-methylpyridine-3-carboxamide
CID 79290970
ethane;[1-(1H-indol-3-yl)cyclopropyl]methanamine
CID 159069082
(2S)-2-amino-3-(1H-indol-3-yl)propanoic acid;pyridine-3-carboxylic acid
CID 18645438
N-[2,2-dimethyl-3-[methyl(pyridine-3-carbonyl)amino]propyl]-N-methylpyridine-3-carboxamide
CID 166390474
[1-(1H-indol-3-yl)-1-oxopropan-2-yl] pyridine-3-carboxylate
CID 43001103

Frequently Asked Questions

What is the IUPAC name of N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide?
The IUPAC name of N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide (CID 113084830) is N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide.
What is the SMILES notation for N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide?
The canonical SMILES for N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide is CN(CC1(c2c[nH]c3ccccc23)CC1)C(=O)c1cccnc1.
What is the InChIKey of N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide?
The InChIKey is IFEKHYJJWHLVPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-22(18(23)14-5-4-10-20-11-14)13-19(8-9-19)16-12-21-17-7-3-2-6-15(16)17/h2-7,10-12,21H,8-9,13H2,1H3.
What are the key properties of N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide?
N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(1H-indol-3-yl)cyclopropyl]methyl]-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 113084830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).