[2-(cycloheptylmethoxy)-4-pyridinyl]methanamine

C14H22N2O — CID 114247934

IUPAC[2-(cycloheptylmethoxy)-4-pyridinyl]methanamine
SMILESNCc1ccnc(OCC2CCCCCC2)c1
InChIInChI=1S/C14H22N2O/c15-10-13-7-8-16-14(9-13)17-11-12-5-3-1-2-4-6-12/h7-9,12H,1-6,10-11,15H2
InChIKeyJWFROKMRCJXUCF-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.89
Rot. Bonds4

About [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine

[2-(cycloheptylmethoxy)-4-pyridinyl]methanamine (PubChem CID 114247934) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(cycloheptylmethoxy)-4-pyridinyl]methanamine
PubChem CID114247934
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name[2-(cycloheptylmethoxy)-4-pyridinyl]methanamine
SMILESNCc1ccnc(OCC2CCCCCC2)c1
InChIInChI=1S/C14H22N2O/c15-10-13-7-8-16-14(9-13)17-11-12-5-3-1-2-4-6-12/h7-9,12H,1-6,10-11,15H2
InChIKeyJWFROKMRCJXUCF-UHFFFAOYSA-N
XLogP2.89
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(cyclohexylmethoxy)-4-pyridinyl]methyl]propan-2-amine
CID 62387269
(1R)-1-[2-(cycloheptylmethoxy)-4-pyridinyl]ethanamine
CID 114248487
2-(cyclohexylmethoxy)pyridine-4-carbothioamide
CID 62384097
[2-[[(2R)-1-methylpyrrolidin-2-yl]methoxy]-4-pyridinyl]methanamine
CID 124673126
[4-(cyclohexylmethoxymethyl)-2-pyridinyl]methanamine
CID 63882665
[4-(cyclohexylmethoxy)-2-pyridinyl]methanamine
CID 62385639
4-chloro-2-(cyclobutylmethoxy)pyridine
CID 71303294
[3-bromo-4-(cyclohexylmethoxy)phenyl]methanamine
CID 63046526
[4-(cyclohexylmethoxy)-3-ethoxyphenyl]methanamine
CID 43122482
[3-(cyclohexylmethoxy)-4-methoxyphenyl]methanamine
CID 43122515
[2-(3-methylcyclohexyl)oxy-4-pyridinyl]methanamine
CID 43126965
[2-(2-fluoroethoxy)-4-pyridinyl]methanamine
CID 171787152

Frequently Asked Questions

What is the IUPAC name of [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine?
The IUPAC name of [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine (CID 114247934) is [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine?
The canonical SMILES for [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine is NCc1ccnc(OCC2CCCCCC2)c1.
What is the InChIKey of [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine?
The InChIKey is JWFROKMRCJXUCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c15-10-13-7-8-16-14(9-13)17-11-12-5-3-1-2-4-6-12/h7-9,12H,1-6,10-11,15H2.
What are the key properties of [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine?
[2-(cycloheptylmethoxy)-4-pyridinyl]methanamine has a molecular weight of 234.34 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cycloheptylmethoxy)-4-pyridinyl]methanamine is sourced from PubChem (CID 114247934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).