5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide

C16H28N4O — CID 51853296

IUPAC5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide
SMILESCC(C)N(C[C@H](C)NC(=O)c1cc(C2CC2)[nH]n1)C(C)C
InChIInChI=1S/C16H28N4O/c1-10(2)20(11(3)4)9-12(5)17-16(21)15-8-14(18-19-15)13-6-7-13/h8,10-13H,6-7,9H2,1-5H3,(H,17,21)(H,18,19)/t12-/m0/s1
InChIKeyGVQTZOOJGUSZPV-LBPRGKRZSA-N
MW292.43 g/mol
LogP2.52
Rot. Bonds7

About 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide

5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide (PubChem CID 51853296) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide
PubChem CID51853296
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide
SMILESCC(C)N(C[C@H](C)NC(=O)c1cc(C2CC2)[nH]n1)C(C)C
InChIInChI=1S/C16H28N4O/c1-10(2)20(11(3)4)9-12(5)17-16(21)15-8-14(18-19-15)13-6-7-13/h8,10-13H,6-7,9H2,1-5H3,(H,17,21)(H,18,19)/t12-/m0/s1
InChIKeyGVQTZOOJGUSZPV-LBPRGKRZSA-N
XLogP2.52
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide with MolForge

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Related Compounds

5-cyclopropyl-N-(1-hydroxypropan-2-yl)-1H-pyrazole-3-carboxamide
CID 146085389
5-cyclopropyl-N-(1-cyclopropylethyl)-1H-pyrazole-3-carboxamide
CID 47158112
5-cyclopropyl-N-[(2R)-1-(1,2,4-triazol-1-yl)propan-2-yl]-1H-pyrazole-3-carboxamide
CID 92582403
methyl 2-[(5-cyclopropyl-1H-pyrazole-3-carbonyl)amino]-4-methylpentanoate
CID 47158124
5-cyclopropyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide
CID 47161141
5-cyclopropyl-N-[(1R)-1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 126448270
5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide
CID 46577659
N-(3-aminobutyl)-5-cyclopropyl-1H-pyrazole-3-carboxamide;hydrochloride
CID 119495448
5-cyclopropyl-N-(1-pyridin-2-ylethyl)-1H-pyrazole-3-carboxamide
CID 43057191
5-cyclopropyl-N-[2-(methylamino)ethyl]-1H-pyrazole-3-carboxamide;hydrochloride
CID 119500515
5-cyclopropyl-N-(2-phenylpropyl)-1H-pyrazole-3-carboxamide
CID 20918125
5-cyclopropyl-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1H-pyrazole-3-carboxamide
CID 47158090

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide (CID 51853296) is 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide is CC(C)N(C[C@H](C)NC(=O)c1cc(C2CC2)[nH]n1)C(C)C.
What is the InChIKey of 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide?
The InChIKey is GVQTZOOJGUSZPV-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H28N4O/c1-10(2)20(11(3)4)9-12(5)17-16(21)15-8-14(18-19-15)13-6-7-13/h8,10-13H,6-7,9H2,1-5H3,(H,17,21)(H,18,19)/t12-/m0/s1.
What are the key properties of 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide?
5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 292.43 g/mol, XLogP of 2.52, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[(2S)-1-[di(propan-2-yl)amino]propan-2-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 51853296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).