3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine

C12H18N2 — CID 104735900

IUPAC3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
SMILESCC1CCC(N)(Cc2cccnc2)C1
InChIInChI=1S/C12H18N2/c1-10-4-5-12(13,7-10)8-11-3-2-6-14-9-11/h2-3,6,9-10H,4-5,7-8,13H2,1H3
InChIKeyZMJXDDSJOAJLAU-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.14
Rot. Bonds2

About 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine

3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine (PubChem CID 104735900) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
PubChem CID104735900
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
SMILESCC1CCC(N)(Cc2cccnc2)C1
InChIInChI=1S/C12H18N2/c1-10-4-5-12(13,7-10)8-11-3-2-6-14-9-11/h2-3,6,9-10H,4-5,7-8,13H2,1H3
InChIKeyZMJXDDSJOAJLAU-UHFFFAOYSA-N
XLogP2.14
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-(pyridin-3-ylmethyl)cyclohexan-1-amine
CID 104735858
1-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine
CID 162146330
4-tert-butyl-1-(pyridin-3-ylmethyl)cycloheptan-1-amine
CID 104735914
4-(pyridin-3-ylmethyl)piperidin-4-amine
CID 86277721
1-[(4-chlorophenyl)methyl]-3-methylcyclopentan-1-amine
CID 64516003
4-methyl-1-(pyridin-3-ylmethyl)cyclohexane-1-carboxylic acid
CID 79425432
2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine
CID 113446872
1-[(5-bromo-3-pyridinyl)methyl]-3-methylcyclohexan-1-amine
CID 104802690
1-[(3-bromophenyl)methyl]-4-methylcyclohexan-1-amine
CID 60799051
1-amino-N,3-dimethyl-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide
CID 64551039
[3-methyl-1-(pyridin-3-ylmethoxy)cyclohexyl]methanamine
CID 65052254
2,2-dimethyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
CID 104735918

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine (CID 104735900) is 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine is CC1CCC(N)(Cc2cccnc2)C1.
What is the InChIKey of 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine?
The InChIKey is ZMJXDDSJOAJLAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-10-4-5-12(13,7-10)8-11-3-2-6-14-9-11/h2-3,6,9-10H,4-5,7-8,13H2,1H3.
What are the key properties of 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine?
3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine has a molecular weight of 190.29 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 104735900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).