(1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine

C13H21NO — CID 81386114

IUPAC(1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine
SMILESCc1ccc(CN[C@@H](C)C2CCCC2)o1
InChIInChI=1S/C13H21NO/c1-10-7-8-13(15-10)9-14-11(2)12-5-3-4-6-12/h7-8,11-12,14H,3-6,9H2,1-2H3/t11-/m0/s1
InChIKeyKJTGYGFUZRXDFW-NSHDSACASA-N
MW207.32 g/mol
LogP3.26
Rot. Bonds4

About (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine

(1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine (PubChem CID 81386114) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name(1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine
PubChem CID81386114
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name(1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine
SMILESCc1ccc(CN[C@@H](C)C2CCCC2)o1
InChIInChI=1S/C13H21NO/c1-10-7-8-13(15-10)9-14-11(2)12-5-3-4-6-12/h7-8,11-12,14H,3-6,9H2,1-2H3/t11-/m0/s1
InChIKeyKJTGYGFUZRXDFW-NSHDSACASA-N
XLogP3.26
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 ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine with MolForge

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Related Compounds

1-(1-ethylpiperidin-4-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine
CID 55081497
5-[[[(1R)-1-cyclopentylethyl]amino]methyl]furan-2-carbonitrile
CID 104865123
1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine
CID 63988709
1-cyclohexyl-N-(furan-2-ylmethyl)ethanamine
CID 43754928
5-[[[(1R)-1-cyclohexylethyl]amino]methyl]furan-2-sulfonamide
CID 81384910
(1S)-1-cyclopentyl-N-[(5-ethylthiophen-2-yl)methyl]ethanamine
CID 81386418
5-[(1-cyclopropylethylamino)methyl]furan-2-carbonitrile
CID 115651606
(1R)-1-cyclopentyl-N-[(4-methylphenyl)methyl]ethanamine
CID 81394920
N'-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethane-1,2-diamine
CID 62523033
5-[[[(1S)-1-cyclopentylethyl]amino]methyl]-3-methylfuran-2-carboxylic acid
CID 103259950
5-[(1-cyclohexylethylamino)methyl]-2-methylfuran-3-carboxylic acid
CID 103249941
(1S)-1-cycloheptyl-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine
CID 81389168

Frequently Asked Questions

What is the IUPAC name of (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine?
The IUPAC name of (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine (CID 81386114) is (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine.
What is the SMILES notation for (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine?
The canonical SMILES for (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine is Cc1ccc(CN[C@@H](C)C2CCCC2)o1.
What is the InChIKey of (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine?
The InChIKey is KJTGYGFUZRXDFW-NSHDSACASA-N. The full InChI is InChI=1S/C13H21NO/c1-10-7-8-13(15-10)9-14-11(2)12-5-3-4-6-12/h7-8,11-12,14H,3-6,9H2,1-2H3/t11-/m0/s1.
What are the key properties of (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine?
(1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine has a molecular weight of 207.32 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine is sourced from PubChem (CID 81386114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).