N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine

C13H21NO — CID 65413778

IUPACN-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine
SMILESCCNC(c1ccco1)C1CCC(C)C1
InChIInChI=1S/C13H21NO/c1-3-14-13(12-5-4-8-15-12)11-7-6-10(2)9-11/h4-5,8,10-11,13-14H,3,6-7,9H2,1-2H3
InChIKeyUFQRRSYEZNZALK-UHFFFAOYSA-N
MW207.32 g/mol
LogP3.37
Rot. Bonds4

About N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine

N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine (PubChem CID 65413778) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine
PubChem CID65413778
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC NameN-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine
SMILESCCNC(c1ccco1)C1CCC(C)C1
InChIInChI=1S/C13H21NO/c1-3-14-13(12-5-4-8-15-12)11-7-6-10(2)9-11/h4-5,8,10-11,13-14H,3,6-7,9H2,1-2H3
InChIKeyUFQRRSYEZNZALK-UHFFFAOYSA-N
XLogP3.37
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine?
The IUPAC name of N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine (CID 65413778) is N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine.
What is the SMILES notation for N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine?
The canonical SMILES for N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine is CCNC(c1ccco1)C1CCC(C)C1.
What is the InChIKey of N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine?
The InChIKey is UFQRRSYEZNZALK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-3-14-13(12-5-4-8-15-12)11-7-6-10(2)9-11/h4-5,8,10-11,13-14H,3,6-7,9H2,1-2H3.
What are the key properties of N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine?
N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine has a molecular weight of 207.32 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine is sourced from PubChem (CID 65413778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).