3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide

C11H21N3O2 — CID 103810507

IUPAC3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide
SMILESCC(C)C(NC(=O)C1CCC(N)C1)C(N)=O
InChIInChI=1S/C11H21N3O2/c1-6(2)9(10(13)15)14-11(16)7-3-4-8(12)5-7/h6-9H,3-5,12H2,1-2H3,(H2,13,15)(H,14,16)
InChIKeyFWKWAZUGLBZBMM-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.26
Rot. Bonds4

About 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide

3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide (PubChem CID 103810507) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide
PubChem CID103810507
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide
SMILESCC(C)C(NC(=O)C1CCC(N)C1)C(N)=O
InChIInChI=1S/C11H21N3O2/c1-6(2)9(10(13)15)14-11(16)7-3-4-8(12)5-7/h6-9H,3-5,12H2,1-2H3,(H2,13,15)(H,14,16)
InChIKeyFWKWAZUGLBZBMM-UHFFFAOYSA-N
XLogP-0.26
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-[(3-aminocyclopentanecarbonyl)amino]-3-methylbutanoic acid
CID 66009453
3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide
CID 130163371
3-amino-N-(1-amino-1-oxopropan-2-yl)cyclopentane-1-carboxamide
CID 66031893
(2S,3R)-2-[(3-aminocyclopentanecarbonyl)amino]-3-hydroxybutanoic acid
CID 104965247
(2S,3S)-2-[(3-aminocyclopentanecarbonyl)amino]-3-methylpentanoic acid
CID 66010236
methyl 2-[(3-aminocyclopentanecarbonyl)amino]propanoate;hydrochloride
CID 119726434
3-amino-N-(1-cyclopentylethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119782445
3-amino-N-[1-(3,4-dimethoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 66010445
3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide
CID 119809033
3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119809032
(2S,3S)-2-[(3-aminocyclohexanecarbonyl)amino]-3-methylpentanoic acid
CID 63044886
(3R)-N-(1-amino-3-methyl-1-oxobutan-2-yl)piperidine-3-carboxamide
CID 106344996

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide (CID 103810507) is 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide is CC(C)C(NC(=O)C1CCC(N)C1)C(N)=O.
What is the InChIKey of 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide?
The InChIKey is FWKWAZUGLBZBMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-6(2)9(10(13)15)14-11(16)7-3-4-8(12)5-7/h6-9H,3-5,12H2,1-2H3,(H2,13,15)(H,14,16).
What are the key properties of 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide?
3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide has a molecular weight of 227.31 g/mol, XLogP of -0.26, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 103810507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).