N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide

C15H23N5O — CID 91792565

IUPACN-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide
SMILESCCn1cc(CN(CC(C)C)C(=O)c2ncc(C)[nH]2)cn1
InChIInChI=1S/C15H23N5O/c1-5-20-10-13(7-17-20)9-19(8-11(2)3)15(21)14-16-6-12(4)18-14/h6-7,10-11H,5,8-9H2,1-4H3,(H,16,18)
InChIKeyPPBFDFQNEXTOQT-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.23
Rot. Bonds6

About N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide

N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide (PubChem CID 91792565) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide.

Molecular Properties

Compound NameN-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide
PubChem CID91792565
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC NameN-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide
SMILESCCn1cc(CN(CC(C)C)C(=O)c2ncc(C)[nH]2)cn1
InChIInChI=1S/C15H23N5O/c1-5-20-10-13(7-17-20)9-19(8-11(2)3)15(21)14-16-6-12(4)18-14/h6-7,10-11H,5,8-9H2,1-4H3,(H,16,18)
InChIKeyPPBFDFQNEXTOQT-UHFFFAOYSA-N
XLogP2.23
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 ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylpyrazol-4-yl)methyl]-N-(2-methylpropyl)-2-methylsulfanylacetamide
CID 91762094
N-[(1-ethylpyrazol-4-yl)methyl]-2-methyl-N-(2-methylpropyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 91771803
2-chloro-N-[(1-ethylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide
CID 166408899
2-[[ethyl-[(1-ethylpyrazol-4-yl)methyl]carbamoyl]amino]acetic acid
CID 121496520
N-[(1-ethylpyrazol-4-yl)methyl]-N-(furan-3-ylmethyl)-2-methylpropan-1-amine
CID 46991462
2-chloro-N-[(1-ethylpyrazol-4-yl)methyl]-N-methylacetamide
CID 19619348
2-[(1-ethylpyrazol-4-yl)carbamoyl-(2-methylpropyl)amino]acetic acid
CID 63065792
ethyl 3-[(1-ethylpyrazol-4-yl)methyl-methylamino]propanoate
CID 55040533
1-ethyl-1-[(1-ethylpyrazol-4-yl)methyl]-3-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]urea
CID 121496517
1-(1-ethylpyrazol-4-yl)-4-methylpentan-3-one
CID 62126384
2-[N-[(1-ethylpyrazol-4-yl)methyl]anilino]acetic acid
CID 62128174
N-[(1-ethylpyrazol-4-yl)methyl]-N,2-dimethylpyrazole-3-carboxamide
CID 19575699

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide?
The IUPAC name of N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide (CID 91792565) is N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide.
What is the SMILES notation for N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide?
The canonical SMILES for N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide is CCn1cc(CN(CC(C)C)C(=O)c2ncc(C)[nH]2)cn1.
What is the InChIKey of N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide?
The InChIKey is PPBFDFQNEXTOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-5-20-10-13(7-17-20)9-19(8-11(2)3)15(21)14-16-6-12(4)18-14/h6-7,10-11H,5,8-9H2,1-4H3,(H,16,18).
What are the key properties of N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide?
N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide is sourced from PubChem (CID 91792565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).