N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine

C18H25N3 — CID 78953374

IUPACN-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine
SMILESCc1cc(NCC2(N(C)C)CCCC2)c2ccccc2n1
InChIInChI=1S/C18H25N3/c1-14-12-17(15-8-4-5-9-16(15)20-14)19-13-18(21(2)3)10-6-7-11-18/h4-5,8-9,12H,6-7,10-11,13H2,1-3H3,(H,19,20)
InChIKeyKGAIKCDTUDRXTA-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.83
Rot. Bonds4

About N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine

N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine (PubChem CID 78953374) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine
PubChem CID78953374
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine
SMILESCc1cc(NCC2(N(C)C)CCCC2)c2ccccc2n1
InChIInChI=1S/C18H25N3/c1-14-12-17(15-8-4-5-9-16(15)20-14)19-13-18(21(2)3)10-6-7-11-18/h4-5,8-9,12H,6-7,10-11,13H2,1-3H3,(H,19,20)
InChIKeyKGAIKCDTUDRXTA-UHFFFAOYSA-N
XLogP3.83
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(aminomethyl)cyclopentyl]methyl]-2-methylquinolin-4-amine
CID 115366049
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-methylquinolin-4-amine
CID 114759234
2-methyl-N-[[1-(methylsulfonylmethyl)cyclopropyl]methyl]quinolin-4-amine
CID 75430530
2-methyl-3-[[(2-methylquinolin-4-yl)amino]methyl]oxolan-3-ol
CID 106102375
N-(2-methylquinolin-4-yl)-N'-propan-2-ylethane-1,2-diamine
CID 62664297
bis(N,N'-bis(2-methylquinolin-4-yl)decane-1,10-diamine);bis(N,N'-bis(2-methylquinolin-4-yl)dodecane-1,12-diamine);hydrate
CID 158378182
N-[(4-ethylphenyl)methyl]-2-methylquinolin-4-amine
CID 106900074
N'-(2-methylquinolin-4-yl)ethane-1,2-diamine;dihydrochloride
CID 46735889
4-[[1-(dimethylamino)cyclopentyl]methylamino]-6-methylpyridine-3-carboxylic acid
CID 83121725
2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine
CID 71899453
1-tert-butyl-2-(2-methylquinolin-4-yl)hydrazine
CID 66835446
2-methyl-N-(2-phenylpropyl)quinolin-4-amine
CID 104591691

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine?
The IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine (CID 78953374) is N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine.
What is the SMILES notation for N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine?
The canonical SMILES for N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine is Cc1cc(NCC2(N(C)C)CCCC2)c2ccccc2n1.
What is the InChIKey of N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine?
The InChIKey is KGAIKCDTUDRXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-14-12-17(15-8-4-5-9-16(15)20-14)19-13-18(21(2)3)10-6-7-11-18/h4-5,8-9,12H,6-7,10-11,13H2,1-3H3,(H,19,20).
What are the key properties of N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine?
N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine has a molecular weight of 283.42 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylquinolin-4-amine is sourced from PubChem (CID 78953374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).