6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid

C10H11N3O3 — CID 62697960

IUPAC6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid
SMILESO=C(Nc1ccc(C(=O)O)cn1)NC1CC1
InChIInChI=1S/C10H11N3O3/c14-9(15)6-1-4-8(11-5-6)13-10(16)12-7-2-3-7/h1,4-5,7H,2-3H2,(H,14,15)(H2,11,12,13,16)
InChIKeyYVJBSFJAKBDVSH-UHFFFAOYSA-N
MW221.22 g/mol
LogP1.06
Rot. Bonds3

About 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid

6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid (PubChem CID 62697960) has the molecular formula C10H11N3O3 and a molecular weight of 221.22 g/mol. Its IUPAC name is 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid
PubChem CID62697960
Molecular FormulaC10H11N3O3
Molecular Weight221.22 g/mol
Exact Mass221.08
IUPAC Name6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid
SMILESO=C(Nc1ccc(C(=O)O)cn1)NC1CC1
InChIInChI=1S/C10H11N3O3/c14-9(15)6-1-4-8(11-5-6)13-10(16)12-7-2-3-7/h1,4-5,7H,2-3H2,(H,14,15)(H2,11,12,13,16)
InChIKeyYVJBSFJAKBDVSH-UHFFFAOYSA-N
XLogP1.06
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 51.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-(cyclopentylamino)pyridine-3-carboxylic acid
CID 1447952
6-(cyclopentanecarbonylamino)pyridine-3-carboxylic acid
CID 22099684
6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide
CID 138025945
4-(cyclooctylcarbamoylamino)benzoic acid
CID 61181422
6-[3-(cyclopropylamino)propylamino]pyridine-3-carboxylic acid
CID 61404521
6-[(3,3-difluorocyclopentanecarbonyl)amino]pyridine-3-carboxylic acid
CID 114226167
1-(5-cyano-2-pyridinyl)-3-cyclohexylurea
CID 55063233
6-(but-2-enoylamino)pyridine-3-carboxylic acid
CID 78969127
1-cyclopropyl-3-[5-(4-methoxyanilino)-2-pyridinyl]urea
CID 113034207
1-cyclohexyl-3-[6-(cyclopropylamino)-3-pyridinyl]urea
CID 113009249
1-[6-(cycloheptylamino)-3-pyridinyl]-3-cyclopropylurea
CID 113014951
1-(5-hydroxy-2-pyridinyl)-3-(oxolan-3-yl)urea
CID 175479949

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid?
The IUPAC name of 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid (CID 62697960) is 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid?
The canonical SMILES for 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid is O=C(Nc1ccc(C(=O)O)cn1)NC1CC1.
What is the InChIKey of 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid?
The InChIKey is YVJBSFJAKBDVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3/c14-9(15)6-1-4-8(11-5-6)13-10(16)12-7-2-3-7/h1,4-5,7H,2-3H2,(H,14,15)(H2,11,12,13,16).
What are the key properties of 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid?
6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid has a molecular weight of 221.22 g/mol, XLogP of 1.06, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid is sourced from PubChem (CID 62697960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).