2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine

C15H25N3 — CID 104822694

IUPAC2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine
SMILESCc1ccc(CN(C)C2CCCCC2CN)cn1
InChIInChI=1S/C15H25N3/c1-12-7-8-13(10-17-12)11-18(2)15-6-4-3-5-14(15)9-16/h7-8,10,14-15H,3-6,9,11,16H2,1-2H3
InChIKeyQRNQBOUCRASCOC-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.34
Rot. Bonds4

About 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine

2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine (PubChem CID 104822694) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine
PubChem CID104822694
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine
SMILESCc1ccc(CN(C)C2CCCCC2CN)cn1
InChIInChI=1S/C15H25N3/c1-12-7-8-13(10-17-12)11-18(2)15-6-4-3-5-14(15)9-16/h7-8,10,14-15H,3-6,9,11,16H2,1-2H3
InChIKeyQRNQBOUCRASCOC-UHFFFAOYSA-N
XLogP2.34
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 ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-[(4-bromo-3-methylphenyl)methyl]-N-methylcyclohexan-1-amine
CID 66478999
N-cyclohexyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexanamine
CID 20791723
2-(aminomethyl)-N-methyl-N-[(4-phenylmethoxyphenyl)methyl]cyclohexan-1-amine
CID 113242171
2-(aminomethyl)-N-(furan-3-ylmethyl)-N-methylcycloheptan-1-amine
CID 61421775
2-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]cyclopentan-1-amine
CID 61414255
1-cyclopropyl-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]ethane-1,2-diamine
CID 116651532
2-(aminomethyl)-N-[(4-chlorophenyl)methyl]-N-methylcyclobutan-1-amine
CID 80996130
1-N,4-N-dimethyl-4-N-[(6-methyl-3-pyridinyl)methyl]cyclohexane-1,4-diamine
CID 113457163
N-methyl-N-[(6-methyl-3-pyridinyl)methyl]piperidin-3-amine
CID 104822677
N-ethyl-5-[[methyl-(2-methylcyclohexyl)amino]methyl]pyridin-2-amine
CID 62208080
2-(aminomethyl)-N-(cyclohexylmethyl)-N-methylcyclohexan-1-amine
CID 61444642
2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine
CID 61419887

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine (CID 104822694) is 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine is Cc1ccc(CN(C)C2CCCCC2CN)cn1.
What is the InChIKey of 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine?
The InChIKey is QRNQBOUCRASCOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-12-7-8-13(10-17-12)11-18(2)15-6-4-3-5-14(15)9-16/h7-8,10,14-15H,3-6,9,11,16H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine?
2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine has a molecular weight of 247.39 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-methyl-N-[(6-methyl-3-pyridinyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 104822694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).