1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide

C14H28N2O2 — CID 119343254

IUPAC1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide
SMILESCCOC(CCNC(=O)C1(N)CCCC1)C(C)C
InChIInChI=1S/C14H28N2O2/c1-4-18-12(11(2)3)7-10-16-13(17)14(15)8-5-6-9-14/h11-12H,4-10,15H2,1-3H3,(H,16,17)
InChIKeyHIJWDRBQMIDGIQ-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.83
Rot. Bonds7

About 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide

1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide (PubChem CID 119343254) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide
PubChem CID119343254
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide
SMILESCCOC(CCNC(=O)C1(N)CCCC1)C(C)C
InChIInChI=1S/C14H28N2O2/c1-4-18-12(11(2)3)7-10-16-13(17)14(15)8-5-6-9-14/h11-12H,4-10,15H2,1-3H3,(H,16,17)
InChIKeyHIJWDRBQMIDGIQ-UHFFFAOYSA-N
XLogP1.83
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(3-methylbutyl)cyclopentane-1-carboxamide
CID 60866848
1-amino-N-(3-cyclopentyl-3-ethoxypropyl)cyclohexane-1-carboxamide
CID 119343531
1-amino-N-(3-methylbutyl)cyclobutane-1-carboxamide
CID 81167864
1-(3-ethoxy-4-methylpentyl)-3-[(1-hydroxycyclobutyl)methyl]urea
CID 111542826
1-amino-N-(4-methylpentyl)cyclobutane-1-carboxamide
CID 81172040
ethyl 3-[(1-aminocyclobutanecarbonyl)amino]propanoate
CID 81169398
5-[(1-aminocyclopentanecarbonyl)amino]-2-methylpentanoic acid
CID 112547802
4-[(1-aminocyclohexanecarbonyl)amino]-2-hydroxybutanoic acid
CID 107836020
(2S)-4-[(1-aminocyclohexanecarbonyl)amino]-2-hydroxybutanoic acid
CID 114006870
1-amino-N-(4-propan-2-yloxybutyl)cyclobutane-1-carboxamide
CID 106011328
1-(3-ethoxy-4-methylpentyl)-3-(2-hydroxycyclohexyl)urea
CID 111542825
1-amino-N-(2-propan-2-yloxyethyl)cyclopropane-1-carboxamide
CID 104761182

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide (CID 119343254) is 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide is CCOC(CCNC(=O)C1(N)CCCC1)C(C)C.
What is the InChIKey of 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide?
The InChIKey is HIJWDRBQMIDGIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-4-18-12(11(2)3)7-10-16-13(17)14(15)8-5-6-9-14/h11-12H,4-10,15H2,1-3H3,(H,16,17).
What are the key properties of 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide?
1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide has a molecular weight of 256.39 g/mol, XLogP of 1.83, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3-ethoxy-4-methylpentyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 119343254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).