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

C19H24N4O2 — CID 51087989

IUPAC3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide
SMILESCn1cc(CCC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cn1
InChIInChI=1S/C19H24N4O2/c1-22-14-16(13-21-22)6-9-18(24)20-12-15-4-7-17(8-5-15)19(25)23-10-2-3-11-23/h4-5,7-8,13-14H,2-3,6,9-12H2,1H3,(H,20,24)
InChIKeyLZUCTIDRLOJQMU-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.91
Rot. Bonds6

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

3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide (PubChem CID 51087989) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide.

Molecular Properties

Compound Name3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide
PubChem CID51087989
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide
SMILESCn1cc(CCC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cn1
InChIInChI=1S/C19H24N4O2/c1-22-14-16(13-21-22)6-9-18(24)20-12-15-4-7-17(8-5-15)19(25)23-10-2-3-11-23/h4-5,7-8,13-14H,2-3,6,9-12H2,1H3,(H,20,24)
InChIKeyLZUCTIDRLOJQMU-UHFFFAOYSA-N
XLogP1.91
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-chloro-4-methylphenyl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide
CID 43043546
1-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-(1-methylpyrazol-4-yl)propan-1-one
CID 47062111
N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]-3-(1,2,4-triazol-1-yl)propanamide
CID 32627824
N-[[2-(hydroxymethyl)phenyl]methyl]-3-(1-methylpyrazol-4-yl)propanamide
CID 47466334
4-[4-[[3-(1-methylpyrazol-4-yl)propanoylamino]methyl]phenoxy]butanoic acid
CID 119247210
2-(4-acetylpiperazin-1-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide
CID 32808855
N-[5-chloro-2-(pyrrolidine-1-carbonyl)phenyl]-3-(1-methylpyrazol-4-yl)propanamide
CID 55873986
N-[(1-methylpyrazol-4-yl)methyl]azepane-1-carboxamide
CID 115590808
3-phenoxy-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide
CID 32854703
N-(cyclobutylmethyl)-3-(1-methylpyrazol-4-yl)propanamide
CID 94609346
[4-(piperidine-1-carbonyl)phenyl]methylurea
CID 51073375
N-[[4-(piperidine-1-carbonyl)phenyl]methyl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 30135469

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide?
The IUPAC name of 3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide (CID 51087989) is 3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide.
What is the SMILES notation for 3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide?
The canonical SMILES for 3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide is Cn1cc(CCC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cn1.
What is the InChIKey of 3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide?
The InChIKey is LZUCTIDRLOJQMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-22-14-16(13-21-22)6-9-18(24)20-12-15-4-7-17(8-5-15)19(25)23-10-2-3-11-23/h4-5,7-8,13-14H,2-3,6,9-12H2,1H3,(H,20,24).
What are the key properties of 3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide?
3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide has a molecular weight of 340.43 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide is sourced from PubChem (CID 51087989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).