N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide

C15H23N5O — CID 138999626

IUPACN,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide
SMILESCCC(CC)n1nc(C(=O)N(C)Cc2cn[nH]c2)cc1C
InChIInChI=1S/C15H23N5O/c1-5-13(6-2)20-11(3)7-14(18-20)15(21)19(4)10-12-8-16-17-9-12/h7-9,13H,5-6,10H2,1-4H3,(H,16,17)
InChIKeyYHCZOICUIYYHIT-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.55
Rot. Bonds6

About N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide

N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide (PubChem CID 138999626) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide
PubChem CID138999626
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC NameN,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide
SMILESCCC(CC)n1nc(C(=O)N(C)Cc2cn[nH]c2)cc1C
InChIInChI=1S/C15H23N5O/c1-5-13(6-2)20-11(3)7-14(18-20)15(21)19(4)10-12-8-16-17-9-12/h7-9,13H,5-6,10H2,1-4H3,(H,16,17)
InChIKeyYHCZOICUIYYHIT-UHFFFAOYSA-N
XLogP2.55
TPSA66.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 4-[methyl(1H-pyrazol-4-ylmethyl)carbamoyl]-1,3-thiazole-2-carboxylate
CID 116698056
N,2,4-trimethyl-N-(1H-pyrazol-4-ylmethyl)-1,3-oxazole-5-carboxamide
CID 79209196
3-hydroxy-N,2-dimethyl-N-(1H-pyrazol-4-ylmethyl)benzamide
CID 82829979
2-[4-[methyl(1H-pyrazol-4-ylmethyl)carbamoyl]triazol-1-yl]acetic acid
CID 66289613
2-(dimethylamino)-N-methyl-N-(1H-pyrazol-4-ylmethyl)acetamide
CID 102737443
4-amino-N,1-dimethyl-N-(1H-pyrazol-4-ylmethyl)pyrazole-5-carboxamide
CID 65359475
2-fluoro-4-hydroxy-N-methyl-N-(1H-pyrazol-4-ylmethyl)benzamide
CID 107676711
(E)-3-[3-methyl-5-[methyl(1H-pyrazol-4-ylmethyl)carbamoyl]thiophen-2-yl]prop-2-enoic acid
CID 79999825
N-methyl-N-(1H-pyrazol-4-ylmethyl)azepane-1-carboxamide
CID 79152116
2-amino-4-bromo-N-methyl-N-(1H-pyrazol-4-ylmethyl)benzamide
CID 79723302
2-amino-6-methoxy-N-methyl-N-(1H-pyrazol-4-ylmethyl)benzamide
CID 81420879
3-methyl-2-[[[methyl(1H-pyrazol-4-ylmethyl)carbamoyl]amino]methyl]butanoic acid
CID 65226677

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide?
The IUPAC name of N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide (CID 138999626) is N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide.
What is the SMILES notation for N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide?
The canonical SMILES for N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide is CCC(CC)n1nc(C(=O)N(C)Cc2cn[nH]c2)cc1C.
What is the InChIKey of N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide?
The InChIKey is YHCZOICUIYYHIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-5-13(6-2)20-11(3)7-14(18-20)15(21)19(4)10-12-8-16-17-9-12/h7-9,13H,5-6,10H2,1-4H3,(H,16,17).
What are the key properties of N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide?
N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-1-pentan-3-yl-N-(1H-pyrazol-4-ylmethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 138999626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).