3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine

C15H25N3 — CID 64554250

IUPAC3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
SMILESCC1CCCC(N)(CN(C)Cc2ccccn2)C1
InChIInChI=1S/C15H25N3/c1-13-6-5-8-15(16,10-13)12-18(2)11-14-7-3-4-9-17-14/h3-4,7,9,13H,5-6,8,10-12,16H2,1-2H3
InChIKeyMRFSDSLXYURHLR-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.42
Rot. Bonds4

About 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine

3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine (PubChem CID 64554250) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
PubChem CID64554250
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
SMILESCC1CCCC(N)(CN(C)Cc2ccccn2)C1
InChIInChI=1S/C15H25N3/c1-13-6-5-8-15(16,10-13)12-18(2)11-14-7-3-4-9-17-14/h3-4,7,9,13H,5-6,8,10-12,16H2,1-2H3
InChIKeyMRFSDSLXYURHLR-UHFFFAOYSA-N
XLogP2.42
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 43565091
1-[2-[methyl(pyridin-2-ylmethyl)amino]ethyl]cyclopentan-1-amine
CID 64677728
1-amino-N-cyclopropyl-3-methyl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
CID 64551877
N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine
CID 83074255
N-[[4-(aminomethyl)oxan-4-yl]methyl]-N-methyl-1-pyridin-2-ylmethanamine
CID 62390958
N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]-1-pyridin-2-ylmethanamine
CID 115246245
N-[(1-amino-3-methylcyclohexyl)methyl]-N-ethyl-2-fluoroaniline
CID 64555317
4-[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclopropyl]aniline
CID 115913060
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
cis-(1R,2S)-N,2-dimethyl-N-[[4-[[methyl(pyridin-2-ylmethyl)amino]methyl]phenyl]methyl]cyclohexan-1-amine
CID 59989994
N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine
CID 62257869

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine (CID 64554250) is 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine is CC1CCCC(N)(CN(C)Cc2ccccn2)C1.
What is the InChIKey of 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is MRFSDSLXYURHLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-13-6-5-8-15(16,10-13)12-18(2)11-14-7-3-4-9-17-14/h3-4,7,9,13H,5-6,8,10-12,16H2,1-2H3.
What are the key properties of 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine?
3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 247.39 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 64554250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).