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

C15H24N2 — CID 82731912

IUPACN-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine
SMILESCCc1cccnc1CNC1CCC(C)(C)C1
InChIInChI=1S/C15H24N2/c1-4-12-6-5-9-16-14(12)11-17-13-7-8-15(2,3)10-13/h5-6,9,13,17H,4,7-8,10-11H2,1-3H3
InChIKeyBRAJVAVEGVCESP-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.31
Rot. Bonds4

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

N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine (PubChem CID 82731912) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine
PubChem CID82731912
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine
SMILESCCc1cccnc1CNC1CCC(C)(C)C1
InChIInChI=1S/C15H24N2/c1-4-12-6-5-9-16-14(12)11-17-13-7-8-15(2,3)10-13/h5-6,9,13,17H,4,7-8,10-11H2,1-3H3
InChIKeyBRAJVAVEGVCESP-UHFFFAOYSA-N
XLogP3.31
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-dimethyl-N-(quinolin-8-ylmethyl)cyclopentan-1-amine
CID 81428857
N-[(3-ethyl-2-pyridinyl)methyl]-2,6-dioxaspiro[4.5]decan-9-amine
CID 82737815
N-[(3-ethyl-2-pyridinyl)methyl]oxetan-3-amine
CID 82732740
3-N-[(3-ethyl-2-pyridinyl)methyl]cyclopentane-1,3-diamine
CID 82733670
3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine
CID 82733186
N-[(3-ethyl-2-pyridinyl)methyl]-2-methyloxan-4-amine
CID 82731940
N-[(3-ethyl-2-pyridinyl)methyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 82733889
1-cyclopropyl-3-[(3-ethyl-2-pyridinyl)methyl]urea
CID 116657152
N-[(3-ethyl-2-pyridinyl)methyl]-3-(3-fluorophenyl)cyclobutan-1-amine
CID 82733626
2-ethyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclopentan-1-amine
CID 113483486
N-[(5-ethylfuran-2-yl)methyl]-3,3-dimethylcyclopentan-1-amine
CID 115881484
3,3-dimethyl-N-[(2-pyrazol-1-ylphenyl)methyl]cyclopentan-1-amine
CID 80706227

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine?
The IUPAC name of N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine (CID 82731912) is N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine.
What is the SMILES notation for N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine?
The canonical SMILES for N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine is CCc1cccnc1CNC1CCC(C)(C)C1.
What is the InChIKey of N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine?
The InChIKey is BRAJVAVEGVCESP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-12-6-5-9-16-14(12)11-17-13-7-8-15(2,3)10-13/h5-6,9,13,17H,4,7-8,10-11H2,1-3H3.
What are the key properties of N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine?
N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethyl-2-pyridinyl)methyl]-3,3-dimethylcyclopentan-1-amine is sourced from PubChem (CID 82731912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).