(3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid

C10H17N3O4 — CID 81118974

IUPAC(3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid
SMILESCC(NC(N)=O)C(=O)N1CCC[C@@H](C(=O)O)C1
InChIInChI=1S/C10H17N3O4/c1-6(12-10(11)17)8(14)13-4-2-3-7(5-13)9(15)16/h6-7H,2-5H2,1H3,(H,15,16)(H3,11,12,17)/t6?,7-/m1/s1
InChIKeyOKBVKDJTDIEGSB-COBSHVIPSA-N
MW243.26 g/mol
LogP-0.63
Rot. Bonds3

About (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid

(3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid (PubChem CID 81118974) has the molecular formula C10H17N3O4 and a molecular weight of 243.26 g/mol. Its IUPAC name is (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid.

Molecular Properties

Compound Name(3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid
PubChem CID81118974
Molecular FormulaC10H17N3O4
Molecular Weight243.26 g/mol
Exact Mass243.12
IUPAC Name(3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid
SMILESCC(NC(N)=O)C(=O)N1CCC[C@@H](C(=O)O)C1
InChIInChI=1S/C10H17N3O4/c1-6(12-10(11)17)8(14)13-4-2-3-7(5-13)9(15)16/h6-7H,2-5H2,1H3,(H,15,16)(H3,11,12,17)/t6?,7-/m1/s1
InChIKeyOKBVKDJTDIEGSB-COBSHVIPSA-N
XLogP-0.63
TPSA112.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 5-0.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-acetamidopropanoyl)piperidine-3-carboxylic acid
CID 43355771
(3R)-1-[2-(carbamoylamino)-3-methylbutanoyl]piperidine-3-carboxylic acid
CID 81118766
(3R)-1-[2-(2,2-dimethylpropanoylamino)propanoyl]piperidine-3-carboxylic acid
CID 81118861
1-[2-(cyclopentanecarbonylamino)propanoyl]piperidine-3-carboxylic acid
CID 119167781
ethyl 1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylate
CID 43404443
(3R)-1-[2-(carbamoylamino)-4-methylpentanoyl]piperidine-3-carboxylic acid
CID 81119735
1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid
CID 119355100
1-[(2R)-2-hydroxypropanoyl]piperidine-3-carboxylic acid
CID 130649320
(3S)-1-(2-methylbutanoyl)piperidine-3-carboxylic acid
CID 81120837
1-[2-(carbamoylamino)-3-methylbutanoyl]pyrrolidine-3-carboxylic acid
CID 55151360
(3S)-1-[(2R)-2-methylpentanoyl]piperidine-3-carboxylic acid
CID 28734803
1-(2,3-dimethylpentanoyl)piperidine-3-carboxylic acid
CID 120512637

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid?
The IUPAC name of (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid (CID 81118974) is (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid.
What is the SMILES notation for (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid?
The canonical SMILES for (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid is CC(NC(N)=O)C(=O)N1CCC[C@@H](C(=O)O)C1.
What is the InChIKey of (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid?
The InChIKey is OKBVKDJTDIEGSB-COBSHVIPSA-N. The full InChI is InChI=1S/C10H17N3O4/c1-6(12-10(11)17)8(14)13-4-2-3-7(5-13)9(15)16/h6-7H,2-5H2,1H3,(H,15,16)(H3,11,12,17)/t6?,7-/m1/s1.
What are the key properties of (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid?
(3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid has a molecular weight of 243.26 g/mol, XLogP of -0.63, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid is sourced from PubChem (CID 81118974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).