N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine

C19H27N3O — CID 54132845

IUPACN-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine
SMILESCOc1cc(NCC2CCCC2CN(C)C)c2ncccc2c1
InChIInChI=1S/C19H27N3O/c1-22(2)13-16-7-4-6-15(16)12-21-18-11-17(23-3)10-14-8-5-9-20-19(14)18/h5,8-11,15-16,21H,4,6-7,12-13H2,1-3H3
InChIKeyOXPGPPUDNPHYQL-UHFFFAOYSA-N
MW313.44 g/mol
LogP3.63
Rot. Bonds6

About N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine

N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine (PubChem CID 54132845) has the molecular formula C19H27N3O and a molecular weight of 313.44 g/mol. Its IUPAC name is N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine.

Molecular Properties

Compound NameN-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine
PubChem CID54132845
Molecular FormulaC19H27N3O
Molecular Weight313.44 g/mol
Exact Mass313.22
IUPAC NameN-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine
SMILESCOc1cc(NCC2CCCC2CN(C)C)c2ncccc2c1
InChIInChI=1S/C19H27N3O/c1-22(2)13-16-7-4-6-15(16)12-21-18-11-17(23-3)10-14-8-5-9-20-19(14)18/h5,8-11,15-16,21H,4,6-7,12-13H2,1-3H3
InChIKeyOXPGPPUDNPHYQL-UHFFFAOYSA-N
XLogP3.63
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.44
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine with MolForge

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Related Compounds

1-(2,6-dimethylpiperidin-1-yl)-3-[(6-methoxyquinolin-8-yl)amino]propan-2-ol;hydrochloride
CID 54609379
6-methoxy-N-(pyridin-2-ylmethyl)quinolin-8-amine
CID 11708748
2-[2-[(6-methoxyquinolin-8-yl)amino]ethyl]guanidine
CID 504257
1-[(6-methoxyquinolin-8-yl)amino]-2-methyl-3-piperidin-1-ylpropan-2-ol;dihydrochloride
CID 76844980
N-(6-methoxyquinolin-8-yl)cyclohexanecarboxamide
CID 684971
N',N'-dibutyl-N-(6-methoxyquinolin-8-yl)ethane-1,2-diamine
CID 44568394
N-[[2-[(methylideneamino)methyl]cyclopentyl]methyl]quinolin-8-amine
CID 54248022
1-[(6-methoxyquinolin-8-yl)amino]-2-methyl-3-[methyl(propyl)amino]propan-2-ol;hydrochloride
CID 53422254
N'-butan-2-yl-N'-ethyl-N-(6-methoxyquinolin-8-yl)ethane-1,2-diamine;dihydrochloride
CID 131882377
N'-ethyl-N-(6-methoxyquinolin-8-yl)-N'-phenylethane-1,2-diamine;hydrochloride
CID 54603031
2-[5-[(6-methoxyquinolin-8-yl)amino]pentyl]guanidine
CID 5160911
N-(6-methoxyquinolin-8-yl)oxolane-2-carboxamide
CID 110715523

Frequently Asked Questions

What is the IUPAC name of N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine?
The IUPAC name of N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine (CID 54132845) is N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine.
What is the SMILES notation for N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine?
The canonical SMILES for N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine is COc1cc(NCC2CCCC2CN(C)C)c2ncccc2c1.
What is the InChIKey of N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine?
The InChIKey is OXPGPPUDNPHYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O/c1-22(2)13-16-7-4-6-15(16)12-21-18-11-17(23-3)10-14-8-5-9-20-19(14)18/h5,8-11,15-16,21H,4,6-7,12-13H2,1-3H3.
What are the key properties of N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine?
N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine has a molecular weight of 313.44 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(dimethylamino)methyl]cyclopentyl]methyl]-6-methoxyquinolin-8-amine is sourced from PubChem (CID 54132845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).