3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide

C9H17N3O2 — CID 130163371

IUPAC3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide
SMILESC[C@H](NC(=O)C1CCC(N)C1)C(N)=O
InChIInChI=1S/C9H17N3O2/c1-5(8(11)13)12-9(14)6-2-3-7(10)4-6/h5-7H,2-4,10H2,1H3,(H2,11,13)(H,12,14)/t5-,6?,7?/m0/s1
InChIKeyLWANKPMYDMBZHV-VTSJMVTISA-N
MW199.25 g/mol
LogP-0.90
Rot. Bonds3

About 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide

3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide (PubChem CID 130163371) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide
PubChem CID130163371
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide
SMILESC[C@H](NC(=O)C1CCC(N)C1)C(N)=O
InChIInChI=1S/C9H17N3O2/c1-5(8(11)13)12-9(14)6-2-3-7(10)4-6/h5-7H,2-4,10H2,1H3,(H2,11,13)(H,12,14)/t5-,6?,7?/m0/s1
InChIKeyLWANKPMYDMBZHV-VTSJMVTISA-N
XLogP-0.90
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-0.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(1-amino-1-oxopropan-2-yl)cyclopentane-1-carboxamide
CID 66031893
methyl 2-[(3-aminocyclopentanecarbonyl)amino]propanoate;hydrochloride
CID 119726434
3-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclopentane-1-carboxamide
CID 103810507
3-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide
CID 103109051
3-amino-N-[1-(tert-butylamino)-1-oxopropan-2-yl]cyclopentane-1-carboxamide
CID 112701696
methyl (2S)-2-[(3-aminocyclohexanecarbonyl)amino]propanoate
CID 63044300
3-amino-N-(1-cyclopentylethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119782445
(2R)-2-[(3-aminocyclopentanecarbonyl)amino]-3-methylbutanoic acid
CID 66009453
(2S,3R)-2-[(3-aminocyclopentanecarbonyl)amino]-3-hydroxybutanoic acid
CID 104965247
3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119809032
3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide
CID 119809033
3-amino-N-(4-propan-2-ylcyclohexyl)cyclopentane-1-carboxamide;hydrochloride
CID 119812000

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide (CID 130163371) is 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide is C[C@H](NC(=O)C1CCC(N)C1)C(N)=O.
What is the InChIKey of 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide?
The InChIKey is LWANKPMYDMBZHV-VTSJMVTISA-N. The full InChI is InChI=1S/C9H17N3O2/c1-5(8(11)13)12-9(14)6-2-3-7(10)4-6/h5-7H,2-4,10H2,1H3,(H2,11,13)(H,12,14)/t5-,6?,7?/m0/s1.
What are the key properties of 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide?
3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide has a molecular weight of 199.25 g/mol, XLogP of -0.90, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 130163371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).