6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one

C13H16N2O — CID 43738023

IUPAC6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(NCC3CC3)ccc2N1
InChIInChI=1S/C13H16N2O/c16-13-6-3-10-7-11(4-5-12(10)15-13)14-8-9-1-2-9/h4-5,7,9,14H,1-3,6,8H2,(H,15,16)
InChIKeyNCRRMURQIHNGBV-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.39
Rot. Bonds3

About 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one

6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 43738023) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one
PubChem CID43738023
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(NCC3CC3)ccc2N1
InChIInChI=1S/C13H16N2O/c16-13-6-3-10-7-11(4-5-12(10)15-13)14-8-9-1-2-9/h4-5,7,9,14H,1-3,6,8H2,(H,15,16)
InChIKeyNCRRMURQIHNGBV-UHFFFAOYSA-N
XLogP2.39
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-(cyclopentylmethylamino)-3,4-dihydro-1H-quinolin-2-one
CID 62071402
6-(3-methylbutylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43737958
ethane;6-(methylamino)-3,4-dihydro-1H-quinolin-2-one
CID 142404052
6-(2,3-diaminopropylamino)-3,4-dihydro-1H-quinolin-2-one
CID 115119383
6-[(3-aminocyclobutyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 80560774
4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]butanenitrile
CID 115231431
N,N-dimethyl-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]acetamide
CID 82498512
tert-butyl N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]ethyl]carbamate
CID 103817909
6-[(4-amino-4-methylpentyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 115205137
6-[(5-bromothiophen-2-yl)methylamino]-3,4-dihydro-1H-quinolin-2-one
CID 43737971
6-(cyclopropylmethylamino)-7-nitro-3,4-dihydro-1H-quinolin-2-one
CID 43449824
6-[(2,4-dihydroxyphenyl)methylamino]-3,4-dihydro-1H-quinolin-2-one
CID 43737966

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one (CID 43738023) is 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(NCC3CC3)ccc2N1.
What is the InChIKey of 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is NCRRMURQIHNGBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c16-13-6-3-10-7-11(4-5-12(10)15-13)14-8-9-1-2-9/h4-5,7,9,14H,1-3,6,8H2,(H,15,16).
What are the key properties of 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one?
6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 216.28 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 43738023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).