N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide

C17H24N2O — CID 106901286

IUPACN-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
SMILESCC(C)CN(C(=O)C1CNc2ccccc2C1)C1CC1
InChIInChI=1S/C17H24N2O/c1-12(2)11-19(15-7-8-15)17(20)14-9-13-5-3-4-6-16(13)18-10-14/h3-6,12,14-15,18H,7-11H2,1-2H3
InChIKeyJXDCIGOKSYWWIE-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.92
Rot. Bonds4

About N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide

N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide (PubChem CID 106901286) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
PubChem CID106901286
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
SMILESCC(C)CN(C(=O)C1CNc2ccccc2C1)C1CC1
InChIInChI=1S/C17H24N2O/c1-12(2)11-19(15-7-8-15)17(20)14-9-13-5-3-4-6-16(13)18-10-14/h3-6,12,14-15,18H,7-11H2,1-2H3
InChIKeyJXDCIGOKSYWWIE-UHFFFAOYSA-N
XLogP2.92
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclobutyl-N-methyl-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901759
N-(2-cyanopropyl)-N-ethyl-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901300
N-(cyclopropylmethyl)-N-ethyl-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901490
N-methyl-N-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 82739395
(3S)-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 34181194
N-[(2S)-1-hydroxypropan-2-yl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 107219186
N,N-bis(2-cyanoethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901307
2-(2-methylpropoxy)ethyl 1,2,3,4-tetrahydroquinoline-3-carboxylate
CID 106902806
(2S)-N-cyclopropyl-N-ethyl-2,3-dihydro-1H-indole-2-carboxamide
CID 61155358
N-(2-cyanoethyl)-N-ethyl-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901308
methyl 4-[methyl(1,2,3,4-tetrahydroquinoline-3-carbonyl)amino]butanoate
CID 106901292
ethane;ethyl 1,2,3,4-tetrahydroquinoline-3-carboxylate
CID 91170420

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
The IUPAC name of N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide (CID 106901286) is N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide is CC(C)CN(C(=O)C1CNc2ccccc2C1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
The InChIKey is JXDCIGOKSYWWIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-12(2)11-19(15-7-8-15)17(20)14-9-13-5-3-4-6-16(13)18-10-14/h3-6,12,14-15,18H,7-11H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide has a molecular weight of 272.39 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide is sourced from PubChem (CID 106901286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).