N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide

C14H17N3O — CID 63194016

IUPACN-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide
SMILESCC(C)(CN)NC(=O)c1ccc2ncccc2c1
InChIInChI=1S/C14H17N3O/c1-14(2,9-15)17-13(18)11-5-6-12-10(8-11)4-3-7-16-12/h3-8H,9,15H2,1-2H3,(H,17,18)
InChIKeyFHDCMAWDAGICET-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.70
Rot. Bonds3

About N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide

N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide (PubChem CID 63194016) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide
PubChem CID63194016
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide
SMILESCC(C)(CN)NC(=O)c1ccc2ncccc2c1
InChIInChI=1S/C14H17N3O/c1-14(2,9-15)17-13(18)11-5-6-12-10(8-11)4-3-7-16-12/h3-8H,9,15H2,1-2H3,(H,17,18)
InChIKeyFHDCMAWDAGICET-UHFFFAOYSA-N
XLogP1.70
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-3-methylpentan-3-yl)quinoline-6-carboxamide
CID 106164388
2-methyl-2-(quinoline-6-carbonylamino)propanoic acid
CID 62849360
N-(1-amino-2-methylpropan-2-yl)naphthalene-2-carboxamide;hydrochloride
CID 119524758
N-(1-aminopropan-2-yl)quinoline-6-carboxamide
CID 63730919
N-(3-amino-2-methylpropyl)quinoline-6-carboxamide
CID 55126976
ethane;quinoline-6-carboxylic acid
CID 91364452
tert-butyl N-(quinoline-6-carbonylamino)carbamate
CID 155213246
N-(2-amino-2-sulfanylideneethyl)quinoline-6-carboxamide
CID 62850973
3-N-(1-amino-2-methylpropan-2-yl)benzene-1,3-dicarboxamide;hydrochloride
CID 119523948
N-(4-hydroxy-2,2-dimethylpentyl)quinoline-6-carboxamide
CID 111480649
2-tert-butylsulfanyl-1-quinolin-6-ylethanone
CID 81219969
N-(2-chloroethyl)quinoline-6-carboxamide
CID 62874874

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide (CID 63194016) is N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide is CC(C)(CN)NC(=O)c1ccc2ncccc2c1.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide?
The InChIKey is FHDCMAWDAGICET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-14(2,9-15)17-13(18)11-5-6-12-10(8-11)4-3-7-16-12/h3-8H,9,15H2,1-2H3,(H,17,18).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide?
N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)quinoline-6-carboxamide is sourced from PubChem (CID 63194016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).