N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide

C8H15N3O — CID 175248822

IUPACN-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide
SMILESCCNC(=O)N1N=C(C)CC1C
InChIInChI=1S/C8H15N3O/c1-4-9-8(12)11-7(3)5-6(2)10-11/h7H,4-5H2,1-3H3,(H,9,12)
InChIKeyADRCFKDWNCVTPR-UHFFFAOYSA-N
MW169.23 g/mol
LogP1.19
Rot. Bonds1

About N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide

N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide (PubChem CID 175248822) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide
PubChem CID175248822
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC NameN-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide
SMILESCCNC(=O)N1N=C(C)CC1C
InChIInChI=1S/C8H15N3O/c1-4-9-8(12)11-7(3)5-6(2)10-11/h7H,4-5H2,1-3H3,(H,9,12)
InChIKeyADRCFKDWNCVTPR-UHFFFAOYSA-N
XLogP1.19
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Methyl-3,4-dihydropyrazole-2-carboxamide
CID 558088
2-Pyrazoline-1-carboxamide, 3,5-dimethyl-
CID 558150
5-Ethyl-3,4-dihydropyrazole-2-carboxamide
CID 55281911
N,5-dipentyl-3,4-dihydropyrazole-2-carboxamide
CID 67944750
3-methyl-N-propan-2-yl-3,4-dihydropyrazole-2-carboxamide
CID 86124292
N-propan-2-yl-3,4-dihydropyrazole-2-carboxamide
CID 90925868
5-methyl-N-[(1R)-1-methylalumanylethyl]-3,4-dihydropyrazole-2-carboxamide
CID 163764972
5-methyl-N-(methylalumanylmethyl)-3,4-dihydropyrazole-2-carboxamide
CID 163785401
N-tert-butyl-5-methyl-3,4-dihydropyrazole-2-carboxamide
CID 163935981
5-butyl-2-cyclopropyl-4H-1,2,4-triazol-3-one
CID 176721463
1-(3,5-Dimethyl-5-(methylamino)-4,5-dihydro-1H-pyrazol-1-yl)ethanone
CID 15185192
N,5-Dimethyl-4,5-dihydro-1H-pyrazole-1-carboxamide
CID 45084154

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide?
The IUPAC name of N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide (CID 175248822) is N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide.
What is the SMILES notation for N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide?
The canonical SMILES for N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide is CCNC(=O)N1N=C(C)CC1C.
What is the InChIKey of N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide?
The InChIKey is ADRCFKDWNCVTPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-4-9-8(12)11-7(3)5-6(2)10-11/h7H,4-5H2,1-3H3,(H,9,12).
What are the key properties of N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide?
N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide has a molecular weight of 169.23 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,5-dimethyl-3,4-dihydropyrazole-2-carboxamide is sourced from PubChem (CID 175248822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).