3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine

C17H19N3O — CID 107332164

IUPAC3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine
SMILESCNC(CCc1ccco1)c1ccnn1-c1ccccc1
InChIInChI=1S/C17H19N3O/c1-18-16(10-9-15-8-5-13-21-15)17-11-12-19-20(17)14-6-3-2-4-7-14/h2-8,11-13,16,18H,9-10H2,1H3
InChIKeyFUYPWODQKQPOAF-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.36
Rot. Bonds6

About 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine

3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine (PubChem CID 107332164) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine
PubChem CID107332164
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine
SMILESCNC(CCc1ccco1)c1ccnn1-c1ccccc1
InChIInChI=1S/C17H19N3O/c1-18-16(10-9-15-8-5-13-21-15)17-11-12-19-20(17)14-6-3-2-4-7-14/h2-8,11-13,16,18H,9-10H2,1H3
InChIKeyFUYPWODQKQPOAF-UHFFFAOYSA-N
XLogP3.36
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(furan-2-yl)-1-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 105307383
2-methoxy-N-methyl-1-(2-phenylpyrazol-3-yl)ethanamine
CID 107330555
N-methyl-2-methylsulfonyl-1-(2-phenylpyrazol-3-yl)ethanamine
CID 107331976
1-(1-ethylpyrazol-4-yl)-3-(furan-2-yl)-N-methylpropan-1-amine
CID 105108978
1-(1,4-dimethylpyrazol-5-yl)-3-(furan-2-yl)-N-methylpropan-1-amine
CID 112742517
[1-(2-ethylpyrazol-3-yl)-3-(furan-2-yl)propyl]hydrazine
CID 105307153
N,2-dimethyl-1-(2-phenylpyrazol-3-yl)propan-1-amine
CID 107330520
3-(furan-2-yl)-1-(3-methoxy-2-pyridinyl)-N-methylpropan-1-amine
CID 114054705
3-(furan-2-yl)-1-isoquinolin-4-yl-N-methylpropan-1-amine
CID 105147383
1-(3-bromofuran-2-yl)-3-(furan-2-yl)-N-methylpropan-1-amine
CID 105150536
3-(furan-2-yl)-N-methyl-1-[2-(trifluoromethoxy)phenyl]propan-1-amine
CID 105141555
4-chloro-5-[[(2S)-4-(furan-2-yl)butan-2-yl]amino]-2-phenylpyridazin-3-one
CID 9340704

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine?
The IUPAC name of 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine (CID 107332164) is 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine is CNC(CCc1ccco1)c1ccnn1-c1ccccc1.
What is the InChIKey of 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine?
The InChIKey is FUYPWODQKQPOAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-18-16(10-9-15-8-5-13-21-15)17-11-12-19-20(17)14-6-3-2-4-7-14/h2-8,11-13,16,18H,9-10H2,1H3.
What are the key properties of 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine?
3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine has a molecular weight of 281.36 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-methyl-1-(2-phenylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 107332164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).