4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide

C16H17N7O — CID 58014875

IUPAC4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide
SMILESNC(=O)c1cnc(Nc2ccc3nccn3c2)nc1NC1CCC1
InChIInChI=1S/C16H17N7O/c17-14(24)12-8-19-16(22-15(12)20-10-2-1-3-10)21-11-4-5-13-18-6-7-23(13)9-11/h4-10H,1-3H2,(H2,17,24)(H2,19,20,21,22)
InChIKeyRKBLDEARFOBJNW-UHFFFAOYSA-N
MW323.36 g/mol
LogP1.93
Rot. Bonds5

About 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide

4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide (PubChem CID 58014875) has the molecular formula C16H17N7O and a molecular weight of 323.36 g/mol. Its IUPAC name is 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide
PubChem CID58014875
Molecular FormulaC16H17N7O
Molecular Weight323.36 g/mol
Exact Mass323.15
IUPAC Name4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide
SMILESNC(=O)c1cnc(Nc2ccc3nccn3c2)nc1NC1CCC1
InChIInChI=1S/C16H17N7O/c17-14(24)12-8-19-16(22-15(12)20-10-2-1-3-10)21-11-4-5-13-18-6-7-23(13)9-11/h4-10H,1-3H2,(H2,17,24)(H2,19,20,21,22)
InChIKeyRKBLDEARFOBJNW-UHFFFAOYSA-N
XLogP1.93
TPSA110.23 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 51.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide?
The IUPAC name of 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide (CID 58014875) is 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide.
What is the SMILES notation for 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide?
The canonical SMILES for 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide is NC(=O)c1cnc(Nc2ccc3nccn3c2)nc1NC1CCC1.
What is the InChIKey of 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide?
The InChIKey is RKBLDEARFOBJNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N7O/c17-14(24)12-8-19-16(22-15(12)20-10-2-1-3-10)21-11-4-5-13-18-6-7-23(13)9-11/h4-10H,1-3H2,(H2,17,24)(H2,19,20,21,22).
What are the key properties of 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide?
4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide has a molecular weight of 323.36 g/mol, XLogP of 1.93, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclobutylamino)-2-(imidazo[1,2-a]pyridin-6-ylamino)pyrimidine-5-carboxamide is sourced from PubChem (CID 58014875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).