N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide

C18H27N5O — CID 70711823

IUPACN-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide
SMILESCC(C)c1cc(NCCC(=O)NC2CCCCC2)n2nccc2n1
InChIInChI=1S/C18H27N5O/c1-13(2)15-12-17(23-16(22-15)8-11-20-23)19-10-9-18(24)21-14-6-4-3-5-7-14/h8,11-14,19H,3-7,9-10H2,1-2H3,(H,21,24)
InChIKeyQJKOJUOJYZUSMZ-UHFFFAOYSA-N
MW329.45 g/mol
LogP3.10
Rot. Bonds6

About N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide

N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide (PubChem CID 70711823) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide
PubChem CID70711823
Molecular FormulaC18H27N5O
Molecular Weight329.45 g/mol
Exact Mass329.22
IUPAC NameN-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide
SMILESCC(C)c1cc(NCCC(=O)NC2CCCCC2)n2nccc2n1
InChIInChI=1S/C18H27N5O/c1-13(2)15-12-17(23-16(22-15)8-11-20-23)19-10-9-18(24)21-14-6-4-3-5-7-14/h8,11-14,19H,3-7,9-10H2,1-2H3,(H,21,24)
InChIKeyQJKOJUOJYZUSMZ-UHFFFAOYSA-N
XLogP3.10
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide 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-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide?
The IUPAC name of N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide (CID 70711823) is N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide.
What is the SMILES notation for N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide?
The canonical SMILES for N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide is CC(C)c1cc(NCCC(=O)NC2CCCCC2)n2nccc2n1.
What is the InChIKey of N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide?
The InChIKey is QJKOJUOJYZUSMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O/c1-13(2)15-12-17(23-16(22-15)8-11-20-23)19-10-9-18(24)21-14-6-4-3-5-7-14/h8,11-14,19H,3-7,9-10H2,1-2H3,(H,21,24).
What are the key properties of N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide?
N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide has a molecular weight of 329.45 g/mol, XLogP of 3.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-[(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propanamide is sourced from PubChem (CID 70711823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).