(2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide

C19H27N3O2 — CID 97224398

IUPAC(2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide
SMILESCC(C)COc1ccc([C@@H](C)NC(=O)[C@H](C)c2cnn(C)c2)cc1
InChIInChI=1S/C19H27N3O2/c1-13(2)12-24-18-8-6-16(7-9-18)15(4)21-19(23)14(3)17-10-20-22(5)11-17/h6-11,13-15H,12H2,1-5H3,(H,21,23)/t14-,15-/m1/s1
InChIKeyPYMRPFIJYCQWIY-HUUCEWRRSA-N
MW329.44 g/mol
LogP3.44
Rot. Bonds7

About (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide

(2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide (PubChem CID 97224398) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide.

Molecular Properties

Compound Name(2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide
PubChem CID97224398
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC Name(2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide
SMILESCC(C)COc1ccc([C@@H](C)NC(=O)[C@H](C)c2cnn(C)c2)cc1
InChIInChI=1S/C19H27N3O2/c1-13(2)12-24-18-8-6-16(7-9-18)15(4)21-19(23)14(3)17-10-20-22(5)11-17/h6-11,13-15H,12H2,1-5H3,(H,21,23)/t14-,15-/m1/s1
InChIKeyPYMRPFIJYCQWIY-HUUCEWRRSA-N
XLogP3.44
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide 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

(7S,10S,13S)-N-[(1-methylpyrazol-4-yl)methyl]-9,12-dioxo-13-(2-oxopyrrolidin-1-yl)-10-(2-phenylethyl)-2-oxa-8,11-diazabicyclo[13.3.1]nonadeca-1(18),15(19),16-triene-7-carboxamide
CID 165378292
3-(4-methoxyphenyl)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]propanamide
CID 1244077
3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-N-(4-methoxybenzyl)-4,5-dihydroisoxazole-5-carboxamide
CID 3242934
N-[(4-methoxyphenyl)methyl]-2-(5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazol-2-yl)acetamide
CID 5308627
1-[1-methyl-3-(4-phenoxyphenyl)-1H-pyrazol-4-yl]-N-(tetrahydro-2-furanylmethyl)methanamine
CID 16192021
4-fluoro-1-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]pyrazole-5-carboxamide
CID 162642917
(1R)-7-ethoxy-1,3-dimethyl-5-(1-methylpyrazol-4-yl)-1H-3-benzazepin-2-one
CID 168298613
N-[(1-methyl-1H-pyrazol-4-yl)methyl]-9H-xanthene-9-carboxamide
CID 3236180
N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-(4-methoxyphenyl)propanamide
CID 3238161
((S)-4-(4-Methyl-1H-pyrazol-1-yl)-2-oxo-6-(4-(4,4,4-trifluorobutoxy)phenyl)-6-(trifluoromethyl)-1,2,5,6-tetrahydropyridine-3-carbonitrile
CID 118362595
N-{4-[(4-methoxybenzyl)amino]-4-oxobutyl}-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide
CID 2766105
N-[(2-Ethoxyphenyl)methyl]-3-(1H-pyrazol-1-YL)propanamide
CID 16026464

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide?
The IUPAC name of (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide (CID 97224398) is (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide.
What is the SMILES notation for (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide?
The canonical SMILES for (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide is CC(C)COc1ccc([C@@H](C)NC(=O)[C@H](C)c2cnn(C)c2)cc1.
What is the InChIKey of (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide?
The InChIKey is PYMRPFIJYCQWIY-HUUCEWRRSA-N. The full InChI is InChI=1S/C19H27N3O2/c1-13(2)12-24-18-8-6-16(7-9-18)15(4)21-19(23)14(3)17-10-20-22(5)11-17/h6-11,13-15H,12H2,1-5H3,(H,21,23)/t14-,15-/m1/s1.
What are the key properties of (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide?
(2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide has a molecular weight of 329.44 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1R)-1-[4-(2-methylpropoxy)phenyl]ethyl]-2-(1-methylpyrazol-4-yl)propanamide is sourced from PubChem (CID 97224398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).