N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide

C15H18N4O — CID 42897384

IUPACN-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide
SMILESCn1ccc(NC(C(=O)NC2CC2)c2ccccc2)n1
InChIInChI=1S/C15H18N4O/c1-19-10-9-13(18-19)17-14(11-5-3-2-4-6-11)15(20)16-12-7-8-12/h2-6,9-10,12,14H,7-8H2,1H3,(H,16,20)(H,17,18)
InChIKeyQWSMIRSNAYLPIT-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.85
Rot. Bonds5

About N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide

N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide (PubChem CID 42897384) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide
PubChem CID42897384
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide
SMILESCn1ccc(NC(C(=O)NC2CC2)c2ccccc2)n1
InChIInChI=1S/C15H18N4O/c1-19-10-9-13(18-19)17-14(11-5-3-2-4-6-11)15(20)16-12-7-8-12/h2-6,9-10,12,14H,7-8H2,1H3,(H,16,20)(H,17,18)
InChIKeyQWSMIRSNAYLPIT-UHFFFAOYSA-N
XLogP1.85
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetic acid
CID 103256803
1-cyclopropyl-3-(1-methylpyrazol-3-yl)urea
CID 115576603
(2S)-2-formamido-N-[4-[[(2R)-2-formamido-2-phenylacetyl]amino]cyclohexyl]-2-phenylacetamide
CID 167001986
(2R)-2-[(1-methylpyrazol-3-yl)carbamoylamino]-2-phenylacetic acid
CID 61206380
2-(4-tert-butylanilino)-N-cyclopropyl-2-phenylacetamide
CID 60597929
(2R)-N-cyclopropyl-2-phenyl-2-[[(2S,3R)-3-pyrazol-1-ylbutan-2-yl]amino]acetamide
CID 100844368
(2R)-N-cyclopropyl-2-phenyl-2-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]acetamide
CID 98759043
(2S)-N-cyclopropyl-2-(2-methoxyanilino)-2-phenylacetamide
CID 41012863
N-cyclopropyl-2-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]-2-phenylacetamide
CID 75457143
N-cyclopropyl-3-[(1-methylpyrazol-3-yl)amino]propanamide
CID 79778658
(2R)-N-cyclopropyl-2-[[(1S)-3-methyl-1-phenylbutyl]amino]-2-phenylacetamide
CID 8646021
N-cyclopropyl-2-(3,4-difluoroanilino)-2-phenylacetamide
CID 51248536

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide?
The IUPAC name of N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide (CID 42897384) is N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide.
What is the SMILES notation for N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide?
The canonical SMILES for N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide is Cn1ccc(NC(C(=O)NC2CC2)c2ccccc2)n1.
What is the InChIKey of N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide?
The InChIKey is QWSMIRSNAYLPIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-19-10-9-13(18-19)17-14(11-5-3-2-4-6-11)15(20)16-12-7-8-12/h2-6,9-10,12,14H,7-8H2,1H3,(H,16,20)(H,17,18).
What are the key properties of N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide?
N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide has a molecular weight of 270.34 g/mol, XLogP of 1.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(1-methylpyrazol-3-yl)amino]-2-phenylacetamide is sourced from PubChem (CID 42897384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).