2-(cyclopropylcarbamoylamino)acetic acid

C6H10N2O3 — CID 16786594

IUPAC2-(cyclopropylcarbamoylamino)acetic acid
SMILESO=C(O)CNC(=O)NC1CC1
InChIInChI=1S/C6H10N2O3/c9-5(10)3-7-6(11)8-4-1-2-4/h4H,1-3H2,(H,9,10)(H2,7,8,11)
InChIKeyVPPKPBFUBVOFLG-UHFFFAOYSA-N
MW158.16 g/mol
LogP-0.47
Rot. Bonds3

About 2-(cyclopropylcarbamoylamino)acetic acid

2-(cyclopropylcarbamoylamino)acetic acid (PubChem CID 16786594) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is 2-(cyclopropylcarbamoylamino)acetic acid.

Molecular Properties

Compound Name2-(cyclopropylcarbamoylamino)acetic acid
PubChem CID16786594
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC Name2-(cyclopropylcarbamoylamino)acetic acid
SMILESO=C(O)CNC(=O)NC1CC1
InChIInChI=1S/C6H10N2O3/c9-5(10)3-7-6(11)8-4-1-2-4/h4H,1-3H2,(H,9,10)(H2,7,8,11)
InChIKeyVPPKPBFUBVOFLG-UHFFFAOYSA-N
XLogP-0.47
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-0.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Carbamoylamino)propanoic acid
CID 426409
(2S)-2-(carbamoylamino)propanoic acid
CID 1535936
N-Carbamoyl-Alanine
CID 1535935
Glycine, N-((butylamino)carbonyl)-
CID 112991
N'-Isopropylureidoacetic acid
CID 541553
Carbonylbisalanin
CID 14332789
(2S)-2-(deuteriocarbamoylamino)propanoic acid
CID 129669105
2-[(1-Aminocyclopropyl)amino]acetic acid
CID 124000294
2-[Cyclopropyl(2,2,2-trifluoroethylcarbamoyl)amino]acetic acid
CID 61185922
2-[[Cyclopropyl(2,2,2-trifluoroethyl)carbamoyl]amino]acetic acid
CID 61607320
2-[Cyclopropyl(3,3,3-trifluoropropylcarbamoyl)amino]acetic acid
CID 63227908
2-[Cyclopropylcarbamoyl(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258306

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylcarbamoylamino)acetic acid?
The IUPAC name of 2-(cyclopropylcarbamoylamino)acetic acid (CID 16786594) is 2-(cyclopropylcarbamoylamino)acetic acid.
What is the SMILES notation for 2-(cyclopropylcarbamoylamino)acetic acid?
The canonical SMILES for 2-(cyclopropylcarbamoylamino)acetic acid is O=C(O)CNC(=O)NC1CC1.
What is the InChIKey of 2-(cyclopropylcarbamoylamino)acetic acid?
The InChIKey is VPPKPBFUBVOFLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c9-5(10)3-7-6(11)8-4-1-2-4/h4H,1-3H2,(H,9,10)(H2,7,8,11).
What are the key properties of 2-(cyclopropylcarbamoylamino)acetic acid?
2-(cyclopropylcarbamoylamino)acetic acid has a molecular weight of 158.16 g/mol, XLogP of -0.47, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylcarbamoylamino)acetic acid is sourced from PubChem (CID 16786594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).