N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide

C16H22N4O2 — CID 138055013

IUPACN-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide
SMILESCC(C)c1ccc(C(=O)NC(CO)Cc2cnn(C)c2)nc1
InChIInChI=1S/C16H22N4O2/c1-11(2)13-4-5-15(17-8-13)16(22)19-14(10-21)6-12-7-18-20(3)9-12/h4-5,7-9,11,14,21H,6,10H2,1-3H3,(H,19,22)
InChIKeyRFJZSPDLVRMFLN-UHFFFAOYSA-N
MW302.38 g/mol
LogP1.27
Rot. Bonds6

About N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide

N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide (PubChem CID 138055013) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide
PubChem CID138055013
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC NameN-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide
SMILESCC(C)c1ccc(C(=O)NC(CO)Cc2cnn(C)c2)nc1
InChIInChI=1S/C16H22N4O2/c1-11(2)13-4-5-15(17-8-13)16(22)19-14(10-21)6-12-7-18-20(3)9-12/h4-5,7-9,11,14,21H,6,10H2,1-3H3,(H,19,22)
InChIKeyRFJZSPDLVRMFLN-UHFFFAOYSA-N
XLogP1.27
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide?
The IUPAC name of N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide (CID 138055013) is N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide.
What is the SMILES notation for N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide?
The canonical SMILES for N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide is CC(C)c1ccc(C(=O)NC(CO)Cc2cnn(C)c2)nc1.
What is the InChIKey of N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide?
The InChIKey is RFJZSPDLVRMFLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-11(2)13-4-5-15(17-8-13)16(22)19-14(10-21)6-12-7-18-20(3)9-12/h4-5,7-9,11,14,21H,6,10H2,1-3H3,(H,19,22).
What are the key properties of N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide?
N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide has a molecular weight of 302.38 g/mol, XLogP of 1.27, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-hydroxy-3-(1-methylpyrazol-4-yl)propan-2-yl]-5-propan-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 138055013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).