3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine

C13H20N2 — CID 114699208

IUPAC3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine
SMILESCc1cnccc1CNC1CCC(C)C1
InChIInChI=1S/C13H20N2/c1-10-3-4-13(7-10)15-9-12-5-6-14-8-11(12)2/h5-6,8,10,13,15H,3-4,7,9H2,1-2H3
InChIKeyLGGVDZAQAGEGRT-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.67
Rot. Bonds3

About 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine

3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine (PubChem CID 114699208) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine
PubChem CID114699208
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine
SMILESCc1cnccc1CNC1CCC(C)C1
InChIInChI=1S/C13H20N2/c1-10-3-4-13(7-10)15-9-12-5-6-14-8-11(12)2/h5-6,8,10,13,15H,3-4,7,9H2,1-2H3
InChIKeyLGGVDZAQAGEGRT-UHFFFAOYSA-N
XLogP2.67
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-[(4-methyl-3-pyridinyl)methyl]cyclopentan-1-amine
CID 114544009
N-[(3-methyl-4-pyridinyl)methyl]-3-propan-2-ylcyclohexan-1-amine
CID 107448832
3-[(3-methyl-4-pyridinyl)methylamino]cyclohexane-1-carboxylic acid
CID 114699082
cis-(1S,3R)-3-methyl-N-[(2-methylphenyl)methyl]cyclopentan-1-amine
CID 95376461
N-[(3-methyl-4-pyridinyl)methyl]-4-phenylcyclohexan-1-amine
CID 114698974
N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 114698856
1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine
CID 114699054
3-(4-methoxyphenyl)-N-[(3-methyl-4-pyridinyl)methyl]cyclobutan-1-amine
CID 114698616
N-[[3-(2,4-dimethylpiperidin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
CID 105073729
2-ethyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine
CID 114698819
2,4,4-trimethyl-N-[(3-methyl-4-pyridinyl)methyl]cyclohexan-1-amine
CID 114698950
2-[[(3-methylcyclopentyl)amino]methyl]aniline
CID 114543904

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine?
The IUPAC name of 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine (CID 114699208) is 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine?
The canonical SMILES for 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine is Cc1cnccc1CNC1CCC(C)C1.
What is the InChIKey of 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine?
The InChIKey is LGGVDZAQAGEGRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-10-3-4-13(7-10)15-9-12-5-6-14-8-11(12)2/h5-6,8,10,13,15H,3-4,7,9H2,1-2H3.
What are the key properties of 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine?
3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine has a molecular weight of 204.32 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 114699208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).