5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide

C15H24N4O2 — CID 133114357

IUPAC5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide
SMILESCCCc1cc(C(=O)N[C@@H]2COC[C@H]2N2CCCC2)n[nH]1
InChIInChI=1S/C15H24N4O2/c1-2-5-11-8-12(18-17-11)15(20)16-13-9-21-10-14(13)19-6-3-4-7-19/h8,13-14H,2-7,9-10H2,1H3,(H,16,20)(H,17,18)/t13-,14-/m1/s1
InChIKeyULCDEABNDLWZPW-ZIAGYGMSSA-N
MW292.38 g/mol
LogP0.96
Rot. Bonds5

About 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide

5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide (PubChem CID 133114357) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide
PubChem CID133114357
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide
SMILESCCCc1cc(C(=O)N[C@@H]2COC[C@H]2N2CCCC2)n[nH]1
InChIInChI=1S/C15H24N4O2/c1-2-5-11-8-12(18-17-11)15(20)16-13-9-21-10-14(13)19-6-3-4-7-19/h8,13-14H,2-7,9-10H2,1H3,(H,16,20)(H,17,18)/t13-,14-/m1/s1
InChIKeyULCDEABNDLWZPW-ZIAGYGMSSA-N
XLogP0.96
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(2-fluorophenoxy)methyl]-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide
CID 56747841
5-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,2-oxazole-3-carboxamide
CID 122556576
N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-4-propylpyrimidine-5-carboxamide
CID 118786538
N-[(3R)-1-oxaspiro[4.5]decan-3-yl]-5-propyl-1H-pyrazole-3-carboxamide
CID 97143610
2-amino-6-methyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]pyrimidine-4-carboxamide
CID 118778494
N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 91829063
5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide
CID 91789169
5-acetyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]thiophene-2-carboxamide
CID 118790643
(5-propyl-1H-pyrazol-3-yl)-(3-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 56818111
N-[2-methyl-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]-5-propyl-1H-pyrazole-3-carboxamide
CID 51871995
2-(ethylamino)-4-methyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1,3-thiazole-5-carboxamide
CID 118794593
N-[[(3S)-oxolan-3-yl]methylsulfonyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 99704126

Frequently Asked Questions

What is the IUPAC name of 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide (CID 133114357) is 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide is CCCc1cc(C(=O)N[C@@H]2COC[C@H]2N2CCCC2)n[nH]1.
What is the InChIKey of 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide?
The InChIKey is ULCDEABNDLWZPW-ZIAGYGMSSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-2-5-11-8-12(18-17-11)15(20)16-13-9-21-10-14(13)19-6-3-4-7-19/h8,13-14H,2-7,9-10H2,1H3,(H,16,20)(H,17,18)/t13-,14-/m1/s1.
What are the key properties of 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide?
5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 0.96, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 133114357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).