N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine

C13H23N3 — CID 115921342

IUPACN-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine
SMILESCCc1[nH]nc(NC(C(C)C)C2CC2)c1C
InChIInChI=1S/C13H23N3/c1-5-11-9(4)13(16-15-11)14-12(8(2)3)10-6-7-10/h8,10,12H,5-7H2,1-4H3,(H2,14,15,16)
InChIKeyBNYGURHOAOLRSL-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.13
Rot. Bonds5

About N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine

N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine (PubChem CID 115921342) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine.

Molecular Properties

Compound NameN-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine
PubChem CID115921342
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine
SMILESCCc1[nH]nc(NC(C(C)C)C2CC2)c1C
InChIInChI=1S/C13H23N3/c1-5-11-9(4)13(16-15-11)14-12(8(2)3)10-6-7-10/h8,10,12H,5-7H2,1-4H3,(H2,14,15,16)
InChIKeyBNYGURHOAOLRSL-UHFFFAOYSA-N
XLogP3.13
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine
CID 115921324
5-ethyl-4-methyl-N-(oxan-4-yl)-1H-pyrazol-3-amine
CID 115735766
5-ethyl-4-methyl-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114697915
5-ethyl-N-(2-ethylbutyl)-4-methyl-1H-pyrazol-3-amine
CID 115757165
5-[(1-cyclopropyl-2-methylpropyl)amino]-3H-1,3,4-thiadiazole-2-thione
CID 130751706
3-cyclopropyl-5-ethyl-4-methyl-1H-pyrazole
CID 171384521
5-ethyl-4-methyl-N-(1H-pyrrol-3-ylmethyl)-1H-pyrazol-3-amine
CID 115735771
N-(1-cyclopropyl-2-methylpropyl)aniline
CID 115729363
5-ethyl-4-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1H-pyrazol-3-amine
CID 71914474
4-cyclopropyl-N-(5-ethyl-4-methyl-1H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide
CID 127679522
5-ethyl-4-methyl-N-[(1-methylpyrrol-2-yl)methyl]-1H-pyrazol-3-amine
CID 115735769
N-(5-ethyl-4-methyl-1H-pyrazol-3-yl)-2,6-difluorobenzamide
CID 155945536

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine?
The IUPAC name of N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine (CID 115921342) is N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine.
What is the SMILES notation for N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine?
The canonical SMILES for N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine is CCc1[nH]nc(NC(C(C)C)C2CC2)c1C.
What is the InChIKey of N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine?
The InChIKey is BNYGURHOAOLRSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-5-11-9(4)13(16-15-11)14-12(8(2)3)10-6-7-10/h8,10,12H,5-7H2,1-4H3,(H2,14,15,16).
What are the key properties of N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine?
N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine has a molecular weight of 221.35 g/mol, XLogP of 3.13, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine is sourced from PubChem (CID 115921342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).