2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid

C9H12N2O3 — CID 117190021

IUPAC2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid
SMILESO=C(O)c1cnc(NC2CCCC2)o1
InChIInChI=1S/C9H12N2O3/c12-8(13)7-5-10-9(14-7)11-6-3-1-2-4-6/h5-6H,1-4H2,(H,10,11)(H,12,13)
InChIKeyPWCILDHVZRDEHU-UHFFFAOYSA-N
MW196.21 g/mol
LogP1.73
Rot. Bonds3

About 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid

2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid (PubChem CID 117190021) has the molecular formula C9H12N2O3 and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid.

Molecular Properties

Compound Name2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid
PubChem CID117190021
Molecular FormulaC9H12N2O3
Molecular Weight196.21 g/mol
Exact Mass196.08
IUPAC Name2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid
SMILESO=C(O)c1cnc(NC2CCCC2)o1
InChIInChI=1S/C9H12N2O3/c12-8(13)7-5-10-9(14-7)11-6-3-1-2-4-6/h5-6H,1-4H2,(H,10,11)(H,12,13)
InChIKeyPWCILDHVZRDEHU-UHFFFAOYSA-N
XLogP1.73
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(cyclohexylamino)furan-2-carboxylic acid
CID 62207046
ethyl 2-[[(1R,3S)-3-(hydroxymethyl)cyclohexyl]amino]-1,3-oxazole-5-carboxylate
CID 166302642
6-(cyclopentylamino)pyridine-3-carboxylic acid
CID 1447952
4-(1,3-oxazol-2-ylamino)cyclohexane-1-carboxylic acid
CID 112710260
6-(cycloheptylamino)pyrazine-2-carboxylic acid
CID 66458367
4-[[2-(cyclopentylamino)-1,3-benzoxazol-6-yl]oxy]pyridine-2-carboxylic acid
CID 142780749
2-(thiolan-3-yl)-1,3-oxazole-5-carboxylic acid
CID 115021666
CID 88981850
CID 88981850
4-(cycloheptylamino)pyridine-3-carboxylic acid
CID 81232550
2-(1-ethylpiperidin-3-yl)-1,3-oxazole-5-carboxylic acid
CID 115085637
5-amino-6-(cyclooctylamino)pyridine-3-carboxylic acid
CID 81438891
6-(cyclooctylamino)pyridazine-3-carboxylic acid
CID 60792420

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid?
The IUPAC name of 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid (CID 117190021) is 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid.
What is the SMILES notation for 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid?
The canonical SMILES for 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid is O=C(O)c1cnc(NC2CCCC2)o1.
What is the InChIKey of 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid?
The InChIKey is PWCILDHVZRDEHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O3/c12-8(13)7-5-10-9(14-7)11-6-3-1-2-4-6/h5-6H,1-4H2,(H,10,11)(H,12,13).
What are the key properties of 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid?
2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid has a molecular weight of 196.21 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-1,3-oxazole-5-carboxylic acid is sourced from PubChem (CID 117190021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).