N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide

C15H25N3O — CID 126808703

IUPACN-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide
SMILESCCCc1cc(C(=O)N(CC2CCC2)C(C)C)n[nH]1
InChIInChI=1S/C15H25N3O/c1-4-6-13-9-14(17-16-13)15(19)18(11(2)3)10-12-7-5-8-12/h9,11-12H,4-8,10H2,1-3H3,(H,16,17)
InChIKeyUZSWKLNFVNFKSF-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.01
Rot. Bonds6

About N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide

N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide (PubChem CID 126808703) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide
PubChem CID126808703
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide
SMILESCCCc1cc(C(=O)N(CC2CCC2)C(C)C)n[nH]1
InChIInChI=1S/C15H25N3O/c1-4-6-13-9-14(17-16-13)15(19)18(11(2)3)10-12-7-5-8-12/h9,11-12H,4-8,10H2,1-3H3,(H,16,17)
InChIKeyUZSWKLNFVNFKSF-UHFFFAOYSA-N
XLogP3.01
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-N-propan-2-yl-2H-triazole-4-carboxamide
CID 78968326
N-ethyl-N-(2-hydroxyethyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 78855350
N-ethyl-N-(2-hydroxy-2-methylpropyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 111596654
[4-[[butyl(methyl)amino]methyl]piperidin-1-yl]-(5-propyl-1H-pyrazol-3-yl)methanone
CID 86824416
N-[[(3R)-1,1-dioxothiolan-3-yl]methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 94006757
N-methyl-5-propyl-N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrazole-3-carboxamide
CID 129329627
N-(cyclopropylmethyl)-6-fluoro-N-propan-2-ylpyridine-2-carboxamide
CID 115497703
[2-[methyl(propan-2-yl)amino]-2-oxoethyl] 5-propyl-1H-pyrazole-3-carboxylate
CID 55601702
N-methyl-5-propyl-N-[1-(4-sulfamoylphenyl)ethyl]-1H-pyrazole-3-carboxamide
CID 24675406
N-(cyclopropylmethyl)-5-(ethylamino)-N-propan-2-ylpyrazine-2-carboxamide
CID 107375257
3,5-dibromo-N-(cyclopropylmethyl)-N-propan-2-ylbenzamide
CID 103907777
N-[1-(2-methoxyphenyl)ethyl]-N-methyl-5-propyl-1H-pyrazole-3-carboxamide
CID 47024435

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide (CID 126808703) is N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide is CCCc1cc(C(=O)N(CC2CCC2)C(C)C)n[nH]1.
What is the InChIKey of N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide?
The InChIKey is UZSWKLNFVNFKSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-6-13-9-14(17-16-13)15(19)18(11(2)3)10-12-7-5-8-12/h9,11-12H,4-8,10H2,1-3H3,(H,16,17).
What are the key properties of N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide?
N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 3.01, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-propan-2-yl-5-propyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 126808703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).