1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine

C15H23N3O — CID 43752010

IUPAC1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine
SMILESCc1cc(C(C)NC(C)c2cnn(C)c2C)c(C)o1
InChIInChI=1S/C15H23N3O/c1-9-7-14(13(5)19-9)10(2)17-11(3)15-8-16-18(6)12(15)4/h7-8,10-11,17H,1-6H3
InChIKeyAPCFHQLOALLHCA-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.35
Rot. Bonds4

About 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine

1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine (PubChem CID 43752010) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine.

Molecular Properties

Compound Name1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine
PubChem CID43752010
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine
SMILESCc1cc(C(C)NC(C)c2cnn(C)c2C)c(C)o1
InChIInChI=1S/C15H23N3O/c1-9-7-14(13(5)19-9)10(2)17-11(3)15-8-16-18(6)12(15)4/h7-8,10-11,17H,1-6H3
InChIKeyAPCFHQLOALLHCA-UHFFFAOYSA-N
XLogP3.35
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(E)-(1,5-dimethylpyrazol-4-yl)methylideneamino]-2-methylfuran-3-carboxamide
CID 5412168
N-[(Z)-(3,5-dimethyl-1-pentylpyrazol-4-yl)methylideneamino]-2,5-dimethylfuran-3-carboxamide
CID 5976730
1,5-dimethyl-N-[[5-methyl-2-(trifluoromethyl)furan-3-yl]methyl]pyrazole-3-carboxamide
CID 2738491
3-(3-Methyl-1H-pyrazol-1-YL)-N-[(5-methylfuran-2-YL)methyl]propanamide
CID 46339419
N-[1-(Furan-2-YL)propan-2-YL]-3-(3-methyl-1H-pyrazol-1-YL)propanamide
CID 46339436
N-[2-(Furan-2-YL)ethyl]-3-(3-methyl-1H-pyrazol-1-YL)propanamide
CID 46339450
1-[(2-Methylfuran-3-yl)methyl]-3-[1-(1,3,5-trimethylpyrazol-4-yl)propan-2-yl]urea
CID 71990490
1-[(2-Methylfuran-3-yl)methyl]-3-[1-(1,3,5-trimethylpyrazol-4-yl)propyl]urea
CID 71990495
2-methyl-N-[(2-methyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-7-yl)methyl]furan-3-carboxamide
CID 118744523
N-(furan-2-ylmethyl)-1-(2-methyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-7-yl)methanamine
CID 118745906
N-(furan-2-ylmethyl)-1-[2-(2-methoxyethyl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-7-yl]methanamine
CID 118746323
(2S)-4-(furan-2-yl)-N-[(3-methyl-1-prop-2-enylpyrazol-4-yl)methyl]butan-2-amine
CID 52384219

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine?
The IUPAC name of 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine (CID 43752010) is 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine.
What is the SMILES notation for 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine?
The canonical SMILES for 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine is Cc1cc(C(C)NC(C)c2cnn(C)c2C)c(C)o1.
What is the InChIKey of 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine?
The InChIKey is APCFHQLOALLHCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-9-7-14(13(5)19-9)10(2)17-11(3)15-8-16-18(6)12(15)4/h7-8,10-11,17H,1-6H3.
What are the key properties of 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine?
1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine has a molecular weight of 261.37 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylfuran-3-yl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine is sourced from PubChem (CID 43752010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).