1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide

C16H19N3O — CID 95593407

IUPAC1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide
SMILESC[C@H](Cn1cccn1)NC(=O)C1(c2ccccc2)CC1
InChIInChI=1S/C16H19N3O/c1-13(12-19-11-5-10-17-19)18-15(20)16(8-9-16)14-6-3-2-4-7-14/h2-7,10-11,13H,8-9,12H2,1H3,(H,18,20)/t13-/m1/s1
InChIKeyRMOMBRBIPANWPC-CYBMUJFWSA-N
MW269.35 g/mol
LogP2.12
Rot. Bonds5

About 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide

1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide (PubChem CID 95593407) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide
PubChem CID95593407
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide
SMILESC[C@H](Cn1cccn1)NC(=O)C1(c2ccccc2)CC1
InChIInChI=1S/C16H19N3O/c1-13(12-19-11-5-10-17-19)18-15(20)16(8-9-16)14-6-3-2-4-7-14/h2-7,10-11,13H,8-9,12H2,1H3,(H,18,20)/t13-/m1/s1
InChIKeyRMOMBRBIPANWPC-CYBMUJFWSA-N
XLogP2.12
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chlorophenyl)-N-(1-pyrazol-1-ylpropan-2-yl)cyclopropane-1-carboxamide
CID 56812614
1-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopropane-1-carboxamide
CID 65463788
2-(1-pyrazol-1-ylpropan-2-ylcarbamoyl)benzoic acid
CID 60940603
1-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclohexane-1-carboxamide;dihydrochloride
CID 119958431
1-(4-fluorophenyl)-N-(2-methyl-3-pyrazol-1-ylpropyl)cyclopropane-1-carboxamide
CID 56818149
3-propyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide
CID 63139178
N-pent-4-yn-2-yl-1-phenylcyclopropane-1-carboxamide
CID 115661895
3-propan-2-yl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide
CID 106979794
(2S)-2-[(1-phenylcyclopropanecarbonyl)amino]propanoic acid
CID 54432657
N-[(2S)-1-aminopropan-2-yl]-1-phenylcyclopentane-1-carboxamide
CID 120505049
N-[(2S)-4-(furan-2-yl)butan-2-yl]-1-phenylcyclopropane-1-carboxamide
CID 95639214
N-[(2R)-2-(ethylamino)propyl]-1-phenylcyclopropane-1-carboxamide
CID 120651845

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide?
The IUPAC name of 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide (CID 95593407) is 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide is C[C@H](Cn1cccn1)NC(=O)C1(c2ccccc2)CC1.
What is the InChIKey of 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide?
The InChIKey is RMOMBRBIPANWPC-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H19N3O/c1-13(12-19-11-5-10-17-19)18-15(20)16(8-9-16)14-6-3-2-4-7-14/h2-7,10-11,13H,8-9,12H2,1H3,(H,18,20)/t13-/m1/s1.
What are the key properties of 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide?
1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]cyclopropane-1-carboxamide is sourced from PubChem (CID 95593407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).