N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine

C17H22N2 — CID 63821632

IUPACN-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine
SMILESCC1(CNCc2cccc3cccnc23)CCCC1
InChIInChI=1S/C17H22N2/c1-17(9-2-3-10-17)13-18-12-15-7-4-6-14-8-5-11-19-16(14)15/h4-8,11,18H,2-3,9-10,12-13H2,1H3
InChIKeyPNNHUWJJZAMXKP-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.90
Rot. Bonds4

About N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine

N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine (PubChem CID 63821632) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine.

Molecular Properties

Compound NameN-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine
PubChem CID63821632
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC NameN-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine
SMILESCC1(CNCc2cccc3cccnc23)CCCC1
InChIInChI=1S/C17H22N2/c1-17(9-2-3-10-17)13-18-12-15-7-4-6-14-8-5-11-19-16(14)15/h4-8,11,18H,2-3,9-10,12-13H2,1H3
InChIKeyPNNHUWJJZAMXKP-UHFFFAOYSA-N
XLogP3.90
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-methyloxetan-3-yl)methyl]-1-quinolin-8-ylmethanamine
CID 78957176
N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine
CID 105415743
N-[(1-methylcyclopentyl)methyl]-1-naphthalen-1-ylmethanamine
CID 63822202
N-[(1-cyclopropylcyclopropyl)methyl]-1-quinolin-8-ylmethanamine
CID 103838629
N-[(3-methyloxetan-3-yl)methyl]-2-quinolin-8-ylethanamine
CID 81428081
1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine
CID 43298300
1-(2,3-difluorophenyl)-N-[(1-methylcyclopentyl)methyl]methanamine
CID 63820897
1-(2,3-dimethylphenyl)-N-(quinolin-8-ylmethyl)methanamine
CID 78980832
N-(quinolin-8-ylmethyl)butan-1-amine
CID 28613793
3-fluoro-N-(quinolin-8-ylmethyl)propan-1-amine
CID 81435594
1-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-2-quinolin-8-ylethanone
CID 120807977
2-methyl-N-(quinolin-8-ylmethyl)propan-2-amine
CID 28608485

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine?
The IUPAC name of N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine (CID 63821632) is N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine.
What is the SMILES notation for N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine?
The canonical SMILES for N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine is CC1(CNCc2cccc3cccnc23)CCCC1.
What is the InChIKey of N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine?
The InChIKey is PNNHUWJJZAMXKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-17(9-2-3-10-17)13-18-12-15-7-4-6-14-8-5-11-19-16(14)15/h4-8,11,18H,2-3,9-10,12-13H2,1H3.
What are the key properties of N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine?
N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine has a molecular weight of 254.38 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine is sourced from PubChem (CID 63821632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).