3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine

C20H24N4 — CID 166253681

IUPAC3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine
SMILESCCc1nn(C)cc1NC(CCc1cccnc1)c1ccccc1
InChIInChI=1S/C20H24N4/c1-3-18-20(15-24(2)23-18)22-19(17-9-5-4-6-10-17)12-11-16-8-7-13-21-14-16/h4-10,13-15,19,22H,3,11-12H2,1-2H3
InChIKeyZBBXOEJTSVUPJP-UHFFFAOYSA-N
MW320.44 g/mol
LogP4.16
Rot. Bonds7

About 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine

3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine (PubChem CID 166253681) has the molecular formula C20H24N4 and a molecular weight of 320.44 g/mol. Its IUPAC name is 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine.

Molecular Properties

Compound Name3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine
PubChem CID166253681
Molecular FormulaC20H24N4
Molecular Weight320.44 g/mol
Exact Mass320.20
IUPAC Name3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine
SMILESCCc1nn(C)cc1NC(CCc1cccnc1)c1ccccc1
InChIInChI=1S/C20H24N4/c1-3-18-20(15-24(2)23-18)22-19(17-9-5-4-6-10-17)12-11-16-8-7-13-21-14-16/h4-10,13-15,19,22H,3,11-12H2,1-2H3
InChIKeyZBBXOEJTSVUPJP-UHFFFAOYSA-N
XLogP4.16
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-1-methyl-N-(1-phenylbutyl)pyrazol-4-amine
CID 103932600
N-[4-(4-bromophenyl)-1-phenylbutyl]-3-ethyl-1-methylpyrazol-4-amine
CID 166383116
3-ethyl-N-[1-(3-fluorophenyl)propyl]-1-methylpyrazol-4-amine
CID 102613275
1-phenyl-N-propyl-4-pyridin-3-ylbutan-1-amine
CID 104737019
N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 105171233
3-ethyl-N-[1-(4-methoxyphenyl)propyl]-1-methylpyrazol-4-amine
CID 103932474
3-ethyl-1-methyl-N-(1-thiophen-3-ylbutyl)pyrazol-4-amine
CID 167861816
N-ethyl-1-phenyl-5-pyridin-3-ylpentan-3-amine
CID 105094322
3-ethyl-1-methyl-N-(3-phenylpropyl)pyrazol-4-amine
CID 107462469
1-(4-methylphenyl)-N-propyl-3-pyridin-3-ylpropan-1-amine
CID 105092564
1-(4-ethylphenyl)-N-(2-pyridin-3-ylethyl)propan-1-amine
CID 60913064
N-ethyl-1-(4-propylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 105144433

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine?
The IUPAC name of 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine (CID 166253681) is 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine.
What is the SMILES notation for 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine?
The canonical SMILES for 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine is CCc1nn(C)cc1NC(CCc1cccnc1)c1ccccc1.
What is the InChIKey of 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine?
The InChIKey is ZBBXOEJTSVUPJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4/c1-3-18-20(15-24(2)23-18)22-19(17-9-5-4-6-10-17)12-11-16-8-7-13-21-14-16/h4-10,13-15,19,22H,3,11-12H2,1-2H3.
What are the key properties of 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine?
3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine has a molecular weight of 320.44 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-methyl-N-(1-phenyl-3-pyridin-3-ylpropyl)pyrazol-4-amine is sourced from PubChem (CID 166253681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).