N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine

C16H23N3 — CID 63975742

IUPACN-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine
SMILESCCCn1nccc1C(CCc1ccccc1)NC
InChIInChI=1S/C16H23N3/c1-3-13-19-16(11-12-18-19)15(17-2)10-9-14-7-5-4-6-8-14/h4-8,11-12,15,17H,3,9-10,13H2,1-2H3
InChIKeyGDEYGYBHUYUOTG-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.19
Rot. Bonds7

About N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine

N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine (PubChem CID 63975742) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine
PubChem CID63975742
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC NameN-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine
SMILESCCCn1nccc1C(CCc1ccccc1)NC
InChIInChI=1S/C16H23N3/c1-3-13-19-16(11-12-18-19)15(17-2)10-9-14-7-5-4-6-8-14/h4-8,11-12,15,17H,3,9-10,13H2,1-2H3
InChIKeyGDEYGYBHUYUOTG-UHFFFAOYSA-N
XLogP3.19
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-(3-methylphenyl)-1-(2-propylpyrazol-3-yl)propan-1-amine
CID 105148148
N-methyl-1-(2-propylpyrazol-3-yl)-3-pyridin-2-ylpropan-1-amine
CID 105148151
N-methyl-1-(2-propylpyrazol-3-yl)-2-pyridin-3-ylethanamine
CID 63977457
N-methyl-1-(2-propylpyrazol-3-yl)-4-thiophen-2-ylbutan-1-amine
CID 105148145
N-methyl-1-(2-propylpyrazol-3-yl)-2-pyridin-4-ylethanamine
CID 63974700
2-ethylsulfanyl-N-methyl-1-(2-propylpyrazol-3-yl)ethanamine
CID 65128079
1-(2-ethylpyrazol-3-yl)-N-methylhexan-1-amine
CID 115858222
N-ethyl-1-(2-propylpyrazol-3-yl)pentan-1-amine
CID 79405561
2-(2-chloro-6-fluorophenyl)-N-methyl-1-(2-propylpyrazol-3-yl)ethanamine
CID 63974493
N-methyl-1-(2-propylpyrazol-3-yl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103215294
2-(2-chlorophenyl)-N-ethyl-1-(2-propylpyrazol-3-yl)ethanamine
CID 63975748
1-(2-fluorophenyl)-N-methyl-1-(2-propylpyrazol-3-yl)methanamine
CID 63976399

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine?
The IUPAC name of N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine (CID 63975742) is N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine is CCCn1nccc1C(CCc1ccccc1)NC.
What is the InChIKey of N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine?
The InChIKey is GDEYGYBHUYUOTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3/c1-3-13-19-16(11-12-18-19)15(17-2)10-9-14-7-5-4-6-8-14/h4-8,11-12,15,17H,3,9-10,13H2,1-2H3.
What are the key properties of N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine?
N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine has a molecular weight of 257.38 g/mol, XLogP of 3.19, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-phenyl-1-(2-propylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 63975742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).