3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine

C15H23N3O2 — CID 105186821

IUPAC3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine
SMILESCNC(CCc1ccco1)c1c(OC)cnn1C(C)C
InChIInChI=1S/C15H23N3O2/c1-11(2)18-15(14(19-4)10-17-18)13(16-3)8-7-12-6-5-9-20-12/h5-6,9-11,13,16H,7-8H2,1-4H3
InChIKeyMHISNFBMRNBDBN-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.96
Rot. Bonds7

About 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine

3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine (PubChem CID 105186821) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine
PubChem CID105186821
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine
SMILESCNC(CCc1ccco1)c1c(OC)cnn1C(C)C
InChIInChI=1S/C15H23N3O2/c1-11(2)18-15(14(19-4)10-17-18)13(16-3)8-7-12-6-5-9-20-12/h5-6,9-11,13,16H,7-8H2,1-4H3
InChIKeyMHISNFBMRNBDBN-UHFFFAOYSA-N
XLogP2.96
TPSA52.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propyl]hydrazine
CID 105339521
1-(1-ethyl-4-methoxypyrazol-5-yl)-3-(furan-2-yl)-N-methylpropan-1-amine
CID 105186645
1-(4-bromo-1-propan-2-ylpyrazol-5-yl)-N-ethyl-3-(furan-2-yl)propan-1-amine
CID 105183823
3-(furan-2-yl)-1-(3-methoxy-2-pyridinyl)-N-methylpropan-1-amine
CID 114054705
1-(1,4-dimethylpyrazol-5-yl)-3-(furan-2-yl)-N-methylpropan-1-amine
CID 112742517
1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N,3,4,4-tetramethylpentan-1-amine
CID 105048330
1-(2-bromofuran-3-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylmethanamine
CID 106858742
3-(furan-2-yl)-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 105130512
1-(1-ethylpyrazol-4-yl)-3-(furan-2-yl)-N-methylpropan-1-amine
CID 105108978
2,2-difluoro-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylethanamine
CID 103517190
1-[1-[2-(dimethylamino)ethyl]-4-methoxypyrazol-5-yl]-3-(furan-2-yl)propan-1-amine
CID 105182777
1-(4-methoxy-1-methylpyrazol-5-yl)-N-methyl-3-phenylpropan-1-amine
CID 114648431

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine?
The IUPAC name of 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine (CID 105186821) is 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine?
The canonical SMILES for 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine is CNC(CCc1ccco1)c1c(OC)cnn1C(C)C.
What is the InChIKey of 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine?
The InChIKey is MHISNFBMRNBDBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-11(2)18-15(14(19-4)10-17-18)13(16-3)8-7-12-6-5-9-20-12/h5-6,9-11,13,16H,7-8H2,1-4H3.
What are the key properties of 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine?
3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine has a molecular weight of 277.37 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 105186821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).