3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide

C17H20N4O2 — CID 31816779

IUPAC3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
SMILESO=C(CCn1cccn1)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C17H20N4O2/c22-16(8-13-21-12-3-9-18-21)19-15-6-4-14(5-7-15)17(23)20-10-1-2-11-20/h3-7,9,12H,1-2,8,10-11,13H2,(H,19,22)
InChIKeyPMVFSRLJMHKKRD-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.15
Rot. Bonds5

About 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide

3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide (PubChem CID 31816779) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide.

Molecular Properties

Compound Name3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
PubChem CID31816779
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
SMILESO=C(CCn1cccn1)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C17H20N4O2/c22-16(8-13-21-12-3-9-18-21)19-15-6-4-14(5-7-15)17(23)20-10-1-2-11-20/h3-7,9,12H,1-2,8,10-11,13H2,(H,19,22)
InChIKeyPMVFSRLJMHKKRD-UHFFFAOYSA-N
XLogP2.15
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-piperidin-1-ylphenyl)-3-pyrazol-1-ylpropanamide
CID 87038105
N,N'-bis[4-(piperidine-1-carbonyl)phenyl]nonanediamide
CID 43878316
N-[4-(cyclopropylcarbamoylamino)phenyl]-3-pyrazol-1-ylpropanamide
CID 87039151
3-pyrazol-1-yl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide
CID 46339350
N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide
CID 87039583
1-N,4-N-bis[4-(pyrrolidine-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 17196721
3-methylsulfonyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 134034714
4-[3-oxo-3-[4-(pyrrolidine-1-carbonyl)anilino]propyl]benzoic acid
CID 119180120
2-amino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 119278060
N-[4-(difluoromethoxy)phenyl]-3-pyrazol-1-ylpropanamide
CID 47175480
N-[4-[[2-[4-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]phenyl]butanamide
CID 54836878
4-(methylamino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]butanamide;hydrochloride
CID 119702385

Frequently Asked Questions

What is the IUPAC name of 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
The IUPAC name of 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide (CID 31816779) is 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide.
What is the SMILES notation for 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
The canonical SMILES for 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide is O=C(CCn1cccn1)Nc1ccc(C(=O)N2CCCC2)cc1.
What is the InChIKey of 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
The InChIKey is PMVFSRLJMHKKRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c22-16(8-13-21-12-3-9-18-21)19-15-6-4-14(5-7-15)17(23)20-10-1-2-11-20/h3-7,9,12H,1-2,8,10-11,13H2,(H,19,22).
What are the key properties of 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide has a molecular weight of 312.37 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazol-1-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide is sourced from PubChem (CID 31816779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).