N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide

C15H21N3O2 — CID 129471954

IUPACN-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide
SMILESO=C(NC(C1CC1)C1CC1)c1cn[nH]c1[C@H]1CCOC1
InChIInChI=1S/C15H21N3O2/c19-15(17-13(9-1-2-9)10-3-4-10)12-7-16-18-14(12)11-5-6-20-8-11/h7,9-11,13H,1-6,8H2,(H,16,18)(H,17,19)/t11-/m0/s1
InChIKeyGIELZPLABPOPBW-NSHDSACASA-N
MW275.35 g/mol
LogP1.83
Rot. Bonds5

About N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide

N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide (PubChem CID 129471954) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide
PubChem CID129471954
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide
SMILESO=C(NC(C1CC1)C1CC1)c1cn[nH]c1[C@H]1CCOC1
InChIInChI=1S/C15H21N3O2/c19-15(17-13(9-1-2-9)10-3-4-10)12-7-16-18-14(12)11-5-6-20-8-11/h7,9-11,13H,1-6,8H2,(H,16,18)(H,17,19)/t11-/m0/s1
InChIKeyGIELZPLABPOPBW-NSHDSACASA-N
XLogP1.83
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide (CID 129471954) is N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide is O=C(NC(C1CC1)C1CC1)c1cn[nH]c1[C@H]1CCOC1.
What is the InChIKey of N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide?
The InChIKey is GIELZPLABPOPBW-NSHDSACASA-N. The full InChI is InChI=1S/C15H21N3O2/c19-15(17-13(9-1-2-9)10-3-4-10)12-7-16-18-14(12)11-5-6-20-8-11/h7,9-11,13H,1-6,8H2,(H,16,18)(H,17,19)/t11-/m0/s1.
What are the key properties of N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide?
N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-5-[(3R)-oxolan-3-yl]-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 129471954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).