2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide

C16H23N5O — CID 120596230

IUPAC2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide
SMILESCN(C)CCn1ccc(NC(=O)C(C)(N)c2ccccc2)n1
InChIInChI=1S/C16H23N5O/c1-16(17,13-7-5-4-6-8-13)15(22)18-14-9-10-21(19-14)12-11-20(2)3/h4-10H,11-12,17H2,1-3H3,(H,18,19,22)
InChIKeyGHERPDBTVXRAHX-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.26
Rot. Bonds6

About 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide

2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide (PubChem CID 120596230) has the molecular formula C16H23N5O and a molecular weight of 301.39 g/mol. Its IUPAC name is 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide
PubChem CID120596230
Molecular FormulaC16H23N5O
Molecular Weight301.39 g/mol
Exact Mass301.19
IUPAC Name2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide
SMILESCN(C)CCn1ccc(NC(=O)C(C)(N)c2ccccc2)n1
InChIInChI=1S/C16H23N5O/c1-16(17,13-7-5-4-6-8-13)15(22)18-14-9-10-21(19-14)12-11-20(2)3/h4-10H,11-12,17H2,1-3H3,(H,18,19,22)
InChIKeyGHERPDBTVXRAHX-UHFFFAOYSA-N
XLogP1.26
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]benzamide
CID 119946927
2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]benzamide;dihydrochloride
CID 119946926
(2S)-2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-4-methylpentanamide
CID 119870197
N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenoxypropanamide
CID 60607724
(2S)-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenoxypropanamide
CID 95685516
4-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]pentanamide;dihydrochloride
CID 120565170
7-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]heptanamide;dihydrochloride
CID 119870128
1-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-3-(2-hydroxy-2-thiophen-3-ylpropyl)urea
CID 111475357
2-amino-N-[1-[2-[2-(dimethylamino)ethylamino]-2-oxoethyl]pyrazol-4-yl]-2-phenylpropanamide
CID 120597193
1-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-3-(4-hydroxy-1-phenylbutyl)urea
CID 111475375
N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-1-phenylpyrrolidine-2-carboxamide
CID 139006084
tert-butyl N-[(2R)-1-[[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]amino]-1-oxopropan-2-yl]carbamate
CID 60622726

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide?
The IUPAC name of 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide (CID 120596230) is 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide is CN(C)CCn1ccc(NC(=O)C(C)(N)c2ccccc2)n1.
What is the InChIKey of 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide?
The InChIKey is GHERPDBTVXRAHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c1-16(17,13-7-5-4-6-8-13)15(22)18-14-9-10-21(19-14)12-11-20(2)3/h4-10H,11-12,17H2,1-3H3,(H,18,19,22).
What are the key properties of 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide?
2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide has a molecular weight of 301.39 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-2-phenylpropanamide is sourced from PubChem (CID 120596230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).