N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide

C14H24N4O — CID 102809870

IUPACN-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide
SMILESCCc1nn(C)cc1C(=O)N(C)C1CCC(N)CC1
InChIInChI=1S/C14H24N4O/c1-4-13-12(9-17(2)16-13)14(19)18(3)11-7-5-10(15)6-8-11/h9-11H,4-8,15H2,1-3H3
InChIKeyKGUKQRWUHXAPKI-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.32
Rot. Bonds3

About N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide

N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide (PubChem CID 102809870) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide
PubChem CID102809870
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide
SMILESCCc1nn(C)cc1C(=O)N(C)C1CCC(N)CC1
InChIInChI=1S/C14H24N4O/c1-4-13-12(9-17(2)16-13)14(19)18(3)11-7-5-10(15)6-8-11/h9-11H,4-8,15H2,1-3H3
InChIKeyKGUKQRWUHXAPKI-UHFFFAOYSA-N
XLogP1.32
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-3-ethyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazole-4-carboxamide
CID 102811034
N-(2-cyanoethyl)-N-cyclopropyl-3-ethyl-1-methylpyrazole-4-carboxamide
CID 103893889
N-(3-aminopropyl)-N-cyclopentyl-3-ethyl-1-methylpyrazole-4-carboxamide
CID 102809889
N-(4-aminocyclohexyl)-N,1,5-trimethylpyrazole-4-carboxamide
CID 79121459
N-(3-bromopropyl)-N-cyclobutyl-3-ethyl-1-methylpyrazole-4-carboxamide
CID 102872261
N-(2-aminoethyl)-N,3-diethyl-1-methylpyrazole-4-carboxamide
CID 102809911
N-(2-aminoethyl)-3-ethyl-1-methyl-N-propylpyrazole-4-carboxamide
CID 102809912
3-ethyl-N,1-dimethyl-N-[2-(methylamino)ethyl]pyrazole-4-carboxamide
CID 102810325
N-[(4-aminophenyl)methyl]-3-ethyl-N,1-dimethylpyrazole-4-carboxamide
CID 102809971
N-(2-aminocyclohexyl)-3-ethyl-1-methylpyrazole-4-carboxamide
CID 102810931
N-(4-aminocyclohexyl)-N-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 114038609
(3-chloro-8-azabicyclo[3.2.1]octan-8-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanone
CID 102811251

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide?
The IUPAC name of N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide (CID 102809870) is N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide?
The canonical SMILES for N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide is CCc1nn(C)cc1C(=O)N(C)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide?
The InChIKey is KGUKQRWUHXAPKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-13-12(9-17(2)16-13)14(19)18(3)11-7-5-10(15)6-8-11/h9-11H,4-8,15H2,1-3H3.
What are the key properties of N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide?
N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-3-ethyl-N,1-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 102809870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).