N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide

C15H24N4O2 — CID 121279533

IUPACN-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide
SMILESCCCC(=O)NC1CCN(C(=O)c2cc(C(C)C)[nH]n2)C1
InChIInChI=1S/C15H24N4O2/c1-4-5-14(20)16-11-6-7-19(9-11)15(21)13-8-12(10(2)3)17-18-13/h8,10-11H,4-7,9H2,1-3H3,(H,16,20)(H,17,18)
InChIKeyOLFMDZINSHQFQJ-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.66
Rot. Bonds5

About N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide

N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide (PubChem CID 121279533) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide.

Molecular Properties

Compound NameN-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide
PubChem CID121279533
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide
SMILESCCCC(=O)NC1CCN(C(=O)c2cc(C(C)C)[nH]n2)C1
InChIInChI=1S/C15H24N4O2/c1-4-5-14(20)16-11-6-7-19(9-11)15(21)13-8-12(10(2)3)17-18-13/h8,10-11H,4-7,9H2,1-3H3,(H,16,20)(H,17,18)
InChIKeyOLFMDZINSHQFQJ-UHFFFAOYSA-N
XLogP1.66
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide?
The IUPAC name of N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide (CID 121279533) is N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide.
What is the SMILES notation for N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide?
The canonical SMILES for N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide is CCCC(=O)NC1CCN(C(=O)c2cc(C(C)C)[nH]n2)C1.
What is the InChIKey of N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide?
The InChIKey is OLFMDZINSHQFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-4-5-14(20)16-11-6-7-19(9-11)15(21)13-8-12(10(2)3)17-18-13/h8,10-11H,4-7,9H2,1-3H3,(H,16,20)(H,17,18).
What are the key properties of N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide?
N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide has a molecular weight of 292.38 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]butanamide is sourced from PubChem (CID 121279533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).