4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine

C15H24N2 — CID 102795078

IUPAC4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine
SMILESCc1ccc(CNC2CCCC(C)CC2)nc1
InChIInChI=1S/C15H24N2/c1-12-4-3-5-14(8-6-12)17-11-15-9-7-13(2)10-16-15/h7,9-10,12,14,17H,3-6,8,11H2,1-2H3
InChIKeyXOZHWNDIFLJNOS-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.45
Rot. Bonds3

About 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine

4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine (PubChem CID 102795078) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine.

Molecular Properties

Compound Name4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine
PubChem CID102795078
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine
SMILESCc1ccc(CNC2CCCC(C)CC2)nc1
InChIInChI=1S/C15H24N2/c1-12-4-3-5-14(8-6-12)17-11-15-9-7-13(2)10-16-15/h7,9-10,12,14,17H,3-6,8,11H2,1-2H3
InChIKeyXOZHWNDIFLJNOS-UHFFFAOYSA-N
XLogP3.45
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(5-methyl-2-pyridinyl)methyl]cyclopropanamine
CID 80708604
4-methyl-N-(pyridin-2-ylmethyl)cycloheptan-1-amine
CID 65080736
2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine
CID 80709898
3-[(5-methyl-2-pyridinyl)methylamino]cyclobutan-1-ol
CID 81312592
6-[[(3-methylcyclohexyl)amino]methyl]pyridin-3-ol
CID 79776311
N-[(2-amino-5-methylphenyl)methyl]-4-methylcycloheptan-1-amine
CID 114100496
N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine
CID 79782890
N-[(5-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 80707817
4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]cycloheptan-1-amine
CID 65079880
4-methyl-N-[(5-methylthiophen-2-yl)methyl]cycloheptan-1-amine
CID 65080142
N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methylcycloheptan-1-amine
CID 102795070
2,2,3,3-tetramethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclopropan-1-amine
CID 81311612

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine?
The IUPAC name of 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine (CID 102795078) is 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine.
What is the SMILES notation for 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine?
The canonical SMILES for 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine is Cc1ccc(CNC2CCCC(C)CC2)nc1.
What is the InChIKey of 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine?
The InChIKey is XOZHWNDIFLJNOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-4-3-5-14(8-6-12)17-11-15-9-7-13(2)10-16-15/h7,9-10,12,14,17H,3-6,8,11H2,1-2H3.
What are the key properties of 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine?
4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(5-methyl-2-pyridinyl)methyl]cycloheptan-1-amine is sourced from PubChem (CID 102795078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).