3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine

C17H28N2O — CID 64920600

IUPAC3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine
SMILESCCC1CCC(NCc2ncc(C)c(OC)c2C)C1C
InChIInChI=1S/C17H28N2O/c1-6-14-7-8-15(12(14)3)19-10-16-13(4)17(20-5)11(2)9-18-16/h9,12,14-15,19H,6-8,10H2,1-5H3
InChIKeyVHVBJASFMPUYQG-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.62
Rot. Bonds5

About 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine

3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine (PubChem CID 64920600) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine
PubChem CID64920600
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine
SMILESCCC1CCC(NCc2ncc(C)c(OC)c2C)C1C
InChIInChI=1S/C17H28N2O/c1-6-14-7-8-15(12(14)3)19-10-16-13(4)17(20-5)11(2)9-18-16/h9,12,14-15,19H,6-8,10H2,1-5H3
InChIKeyVHVBJASFMPUYQG-UHFFFAOYSA-N
XLogP3.62
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine with MolForge

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Related Compounds

N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine
CID 63278062
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-1,3-dimethylpiperidin-4-amine
CID 114503407
3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine
CID 112650199
3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-ol
CID 64910537
(6S)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 95329007
1-(2-bicyclo[2.2.1]heptanyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]methanamine
CID 63681622
(2R)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylpiperidine-1-sulfonamide
CID 94381377
3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine
CID 64923336
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylpentan-3-amine
CID 54954917
3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-one
CID 64906550
3-ethoxy-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propan-1-amine
CID 28584690
N'-cyclopropyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N'-methylethane-1,2-diamine
CID 62977612

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine?
The IUPAC name of 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine (CID 64920600) is 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine is CCC1CCC(NCc2ncc(C)c(OC)c2C)C1C.
What is the InChIKey of 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine?
The InChIKey is VHVBJASFMPUYQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-6-14-7-8-15(12(14)3)19-10-16-13(4)17(20-5)11(2)9-18-16/h9,12,14-15,19H,6-8,10H2,1-5H3.
What are the key properties of 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine?
3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine has a molecular weight of 276.42 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 64920600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).