1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine

C15H24N2 — CID 80692076

IUPAC1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine
SMILESCCc1ccc(CC2(N)CCC(C)(C)C2)nc1
InChIInChI=1S/C15H24N2/c1-4-12-5-6-13(17-10-12)9-15(16)8-7-14(2,3)11-15/h5-6,10H,4,7-9,11,16H2,1-3H3
InChIKeyZOCRCOOPWRVQPM-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.09
Rot. Bonds3

About 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine

1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine (PubChem CID 80692076) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine
PubChem CID80692076
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine
SMILESCCc1ccc(CC2(N)CCC(C)(C)C2)nc1
InChIInChI=1S/C15H24N2/c1-4-12-5-6-13(17-10-12)9-15(16)8-7-14(2,3)11-15/h5-6,10H,4,7-9,11,16H2,1-3H3
InChIKeyZOCRCOOPWRVQPM-UHFFFAOYSA-N
XLogP3.09
TPSA38.91 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 ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(5-ethyl-2-pyridinyl)methyl]-4,4-dimethylcyclohexan-1-amine
CID 79745795
1-[(5-bromo-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine
CID 104802982
1-[(5-ethyl-2-pyridinyl)methyl]-4-methylcycloheptan-1-amine
CID 79745798
1-[(5-ethyl-2-pyridinyl)methyl]-3,3,5,5-tetramethylcyclohexan-1-ol
CID 115999401
1-[(5-ethyl-2-pyridinyl)methyl]-2,4,4-trimethylcyclohexan-1-ol
CID 81314333
4-[(1-amino-3,3-dimethylcyclopentyl)methyl]phenol
CID 80693061
1-[(5-ethyl-2-pyridinyl)methyl]cycloheptan-1-ol
CID 79740505
1-[(5-ethyl-2-pyridinyl)methyl]-2,4-dimethylcyclohexan-1-amine
CID 79746172
3,3-dimethyl-1-[(4-propan-2-ylphenyl)methyl]cyclopentan-1-amine
CID 80705541
1-(1-aminocyclopentyl)-3-(5-ethyl-2-pyridinyl)propan-2-one
CID 116578619
1-[(5-ethyl-2-pyridinyl)methyl]-2,5-dimethylcyclohexan-1-amine
CID 79745148
1-[(5-ethyl-2-pyridinyl)methyl]-4-methylcyclohexan-1-ol
CID 79740612

Frequently Asked Questions

What is the IUPAC name of 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine?
The IUPAC name of 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine (CID 80692076) is 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine.
What is the SMILES notation for 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine?
The canonical SMILES for 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine is CCc1ccc(CC2(N)CCC(C)(C)C2)nc1.
What is the InChIKey of 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine?
The InChIKey is ZOCRCOOPWRVQPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-12-5-6-13(17-10-12)9-15(16)8-7-14(2,3)11-15/h5-6,10H,4,7-9,11,16H2,1-3H3.
What are the key properties of 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine?
1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine is sourced from PubChem (CID 80692076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).