2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide

C9H18N2O — CID 130759051

IUPAC2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide
SMILESCCNC(=O)C[C@@H]1CCC[C@H]1N
InChIInChI=1S/C9H18N2O/c1-2-11-9(12)6-7-4-3-5-8(7)10/h7-8H,2-6,10H2,1H3,(H,11,12)/t7-,8+/m0/s1
InChIKeyXOPPDRGSPPEBGW-JGVFFNPUSA-N
MW170.26 g/mol
LogP0.64
Rot. Bonds3

About 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide

2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide (PubChem CID 130759051) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide.

Molecular Properties

Compound Name2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide
PubChem CID130759051
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide
SMILESCCNC(=O)C[C@@H]1CCC[C@H]1N
InChIInChI=1S/C9H18N2O/c1-2-11-9(12)6-7-4-3-5-8(7)10/h7-8H,2-6,10H2,1H3,(H,11,12)/t7-,8+/m0/s1
InChIKeyXOPPDRGSPPEBGW-JGVFFNPUSA-N
XLogP0.64
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Octanamide, N-(5-amino-2-methylpentyl)-
CID 85630598
N-cyclohexyl-3-cyclopentylpropanamide
CID 835664
N-Butyl-2-ethylhexanamide
CID 24058
Valeramide, N-isopropyl-2-propyl-
CID 200920
Octanamide, N-(5-amino-4-methylpentyl)-
CID 11107544
2-cyclohexyl-N-cyclopentylacetamide
CID 2285482
N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]cyclopentanecarboxamide
CID 90674949
3-cyclohexyl-N-propan-2-ylpropanamide
CID 4144742
Valeramide, N-cyclopentyl-2-propyl-
CID 211205
2-Cyclopentyl-N-[(7-oxoazepan-2-YL)methyl]acetamide
CID 91909429
(1S,11R)-2,9-diazabicyclo[9.3.0]tetradecan-10-one
CID 110199279
N-Isopropyl-8-azaspiro[4.5]decane-2-carboxamide
CID 118738742

Frequently Asked Questions

What is the IUPAC name of 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide?
The IUPAC name of 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide (CID 130759051) is 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide.
What is the SMILES notation for 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide?
The canonical SMILES for 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide is CCNC(=O)C[C@@H]1CCC[C@H]1N.
What is the InChIKey of 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide?
The InChIKey is XOPPDRGSPPEBGW-JGVFFNPUSA-N. The full InChI is InChI=1S/C9H18N2O/c1-2-11-9(12)6-7-4-3-5-8(7)10/h7-8H,2-6,10H2,1H3,(H,11,12)/t7-,8+/m0/s1.
What are the key properties of 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide?
2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide has a molecular weight of 170.26 g/mol, XLogP of 0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide is sourced from PubChem (CID 130759051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).