N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine

C13H19N3O — CID 103009870

IUPACN-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine
SMILESCCNC(CCc1ccnn1C)c1ccco1
InChIInChI=1S/C13H19N3O/c1-3-14-12(13-5-4-10-17-13)7-6-11-8-9-15-16(11)2/h4-5,8-10,12,14H,3,6-7H2,1-2H3
InChIKeyYSQRNUCZDDKWTO-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.30
Rot. Bonds6

About N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine

N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine (PubChem CID 103009870) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine
PubChem CID103009870
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine
SMILESCCNC(CCc1ccnn1C)c1ccco1
InChIInChI=1S/C13H19N3O/c1-3-14-12(13-5-4-10-17-13)7-6-11-8-9-15-16(11)2/h4-5,8-10,12,14H,3,6-7H2,1-2H3
InChIKeyYSQRNUCZDDKWTO-UHFFFAOYSA-N
XLogP2.30
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-(3-methylimidazol-4-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103012068
1-(3-chloro-4-pyridinyl)-N-ethyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030450
N-ethyl-1-(5-iodothiophen-3-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030990
1-(1,3-diethylpyrazol-5-yl)-N-ethyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030515
N-ethyl-1-(2-ethyl-5-methylpyrazol-3-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030441
N-ethyl-1-(2-fluoro-4-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030390
N-ethyl-4-(2-methylpyrazol-3-yl)-1-methylsulfanylbutan-2-amine
CID 103009884
N-ethyl-3-(2-methylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylpropan-1-amine
CID 103128451
N-ethyl-1-(2-methylphenyl)-5-(2-methylpyrazol-3-yl)pentan-3-amine
CID 103030444
5-(3-chlorobutyl)-1-methylpyrazole
CID 64514221
1-cyclobutyl-N-ethyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103010387
N-ethyl-5,7,7-trimethyl-1-(2-methylpyrazol-3-yl)octan-3-amine
CID 103030436

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine?
The IUPAC name of N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine (CID 103009870) is N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine is CCNC(CCc1ccnn1C)c1ccco1.
What is the InChIKey of N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine?
The InChIKey is YSQRNUCZDDKWTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-3-14-12(13-5-4-10-17-13)7-6-11-8-9-15-16(11)2/h4-5,8-10,12,14H,3,6-7H2,1-2H3.
What are the key properties of N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine?
N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine has a molecular weight of 233.31 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(furan-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 103009870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).