[2-(quinolin-2-ylmethyl)cyclohexyl]methanamine

C17H22N2 — CID 81010257

IUPAC[2-(quinolin-2-ylmethyl)cyclohexyl]methanamine
SMILESNCC1CCCCC1Cc1ccc2ccccc2n1
InChIInChI=1S/C17H22N2/c18-12-15-7-2-1-6-14(15)11-16-10-9-13-5-3-4-8-17(13)19-16/h3-5,8-10,14-15H,1-2,6-7,11-12,18H2
InChIKeyIESGESRHSCFPKD-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.54
Rot. Bonds3

About [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine

[2-(quinolin-2-ylmethyl)cyclohexyl]methanamine (PubChem CID 81010257) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[2-(quinolin-2-ylmethyl)cyclohexyl]methanamine
PubChem CID81010257
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name[2-(quinolin-2-ylmethyl)cyclohexyl]methanamine
SMILESNCC1CCCCC1Cc1ccc2ccccc2n1
InChIInChI=1S/C17H22N2/c18-12-15-7-2-1-6-14(15)11-16-10-9-13-5-3-4-8-17(13)19-16/h3-5,8-10,14-15H,1-2,6-7,11-12,18H2
InChIKeyIESGESRHSCFPKD-UHFFFAOYSA-N
XLogP3.54
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(aminomethyl)cyclohexyl]-2-quinolin-2-ylethanone
CID 116584736
quinolin-2-ylmethanamine;dihydrochloride
CID 18507294
trans-(1S,2S)-1-N,2-N-bis(quinolin-2-ylmethyl)cyclohexane-1,2-diamine
CID 70905536
(3S,4R)-4-(quinolin-2-ylmethyl)pyrrolidin-3-ol;dihydrochloride
CID 154919479
N-(quinolin-2-ylmethyl)cyclohexanamine
CID 28774764
4-propyl-2-(quinolin-2-ylmethyl)cyclohexan-1-ol
CID 79423767
5-(quinolin-2-ylmethyl)pyrrolidin-2-one
CID 113441322
1-cyclohexyl-N-(quinolin-2-ylmethyl)methanamine
CID 43216158
2,6-dimethoxy-N-[2-(quinolin-2-ylmethyl)cyclopentyl]benzamide
CID 118024564
2,6-dimethoxy-N-[(1R,2R)-2-(quinolin-2-ylmethyl)cyclopentyl]benzamide
CID 125464627
2-cyclopentyl-1-quinolin-2-ylethanamine
CID 63222470
[2-[(5-bromo-2-pyridinyl)methyl]cyclopentyl]methanamine
CID 104813752

Frequently Asked Questions

What is the IUPAC name of [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine?
The IUPAC name of [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine (CID 81010257) is [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine.
What is the SMILES notation for [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine?
The canonical SMILES for [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine is NCC1CCCCC1Cc1ccc2ccccc2n1.
What is the InChIKey of [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine?
The InChIKey is IESGESRHSCFPKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c18-12-15-7-2-1-6-14(15)11-16-10-9-13-5-3-4-8-17(13)19-16/h3-5,8-10,14-15H,1-2,6-7,11-12,18H2.
What are the key properties of [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine?
[2-(quinolin-2-ylmethyl)cyclohexyl]methanamine has a molecular weight of 254.38 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(quinolin-2-ylmethyl)cyclohexyl]methanamine is sourced from PubChem (CID 81010257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).