(2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide

C13H22N4O — CID 125435652

IUPAC(2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide
SMILESCc1cnn(CCNC(=O)[C@H](C)N2CCCC2)c1
InChIInChI=1S/C13H22N4O/c1-11-9-15-17(10-11)8-5-14-13(18)12(2)16-6-3-4-7-16/h9-10,12H,3-8H2,1-2H3,(H,14,18)/t12-/m0/s1
InChIKeyYPIRUXAGRXDCGW-LBPRGKRZSA-N
MW250.35 g/mol
LogP0.79
Rot. Bonds5

About (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide

(2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide (PubChem CID 125435652) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound Name(2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide
PubChem CID125435652
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name(2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide
SMILESCc1cnn(CCNC(=O)[C@H](C)N2CCCC2)c1
InChIInChI=1S/C13H22N4O/c1-11-9-15-17(10-11)8-5-14-13(18)12(2)16-6-3-4-7-16/h9-10,12H,3-8H2,1-2H3,(H,14,18)/t12-/m0/s1
InChIKeyYPIRUXAGRXDCGW-LBPRGKRZSA-N
XLogP0.79
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide with MolForge

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

Launch Full Analysis

Related Compounds

2-[1-(2,2-dimethylpropyl)-3-oxo-2-piperazinyl]-N-[(1-methyl-1H-pyrazol-4-yl)methyl]acetamide
CID 16190577
4-methyl-1-(pyrrolidin-3-yl)-1H-pyrazole
CID 62329635
3-(4-amino-1H-pyrazol-1-yl)pyrrolidin-2-one
CID 137698641
2-(4-Bromo-1H-pyrazol-1-yl)-N-propylpropanamide
CID 19537573
2-(4-bromopyrazol-1-yl)-N-[3-(diethylamino)propyl]propanamide
CID 19537737
N-[(1-ethylpyrazol-4-yl)methyl]-3-methylbutanamide
CID 35276265
N-[(1-ethylpyrazol-4-yl)methyl]-2-methylpropanamide
CID 39891826
2-(4-Methylpyrazol-1-yl)-1-[4-[(1-propan-2-ylpyrazol-4-yl)methyl]-1,4-diazepan-1-yl]ethanone
CID 53579544
N-(1-ethylpiperidin-4-yl)-2-[2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]acetamide
CID 53590070
1-[2-Oxo-2-[4-[(1-propan-2-ylpyrazol-4-yl)methyl]-1,4-diazepan-1-yl]ethyl]pyrrolidin-2-one
CID 53604942
N-(1-ethylpiperidin-4-yl)-2-[2-[(4-methylpyrazol-1-yl)methyl]piperidin-1-yl]acetamide
CID 53608327
(1-Methylpyrrolidin-2-yl)-[4-[(1-propan-2-ylpyrazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone
CID 53613893

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide?
The IUPAC name of (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide (CID 125435652) is (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide?
The canonical SMILES for (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide is Cc1cnn(CCNC(=O)[C@H](C)N2CCCC2)c1.
What is the InChIKey of (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide?
The InChIKey is YPIRUXAGRXDCGW-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H22N4O/c1-11-9-15-17(10-11)8-5-14-13(18)12(2)16-6-3-4-7-16/h9-10,12H,3-8H2,1-2H3,(H,14,18)/t12-/m0/s1.
What are the key properties of (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide?
(2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide has a molecular weight of 250.35 g/mol, XLogP of 0.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 125435652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).