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

C12H17N3O — CID 103010290

IUPAC1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
SMILESCNC(CCc1ccnn1C)c1ccoc1
InChIInChI=1S/C12H17N3O/c1-13-12(10-6-8-16-9-10)4-3-11-5-7-14-15(11)2/h5-9,12-13H,3-4H2,1-2H3
InChIKeyRIONVXPCPRPZHL-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.91
Rot. Bonds5

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

1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine (PubChem CID 103010290) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
PubChem CID103010290
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
SMILESCNC(CCc1ccnn1C)c1ccoc1
InChIInChI=1S/C12H17N3O/c1-13-12(10-6-8-16-9-10)4-3-11-5-7-14-15(11)2/h5-9,12-13H,3-4H2,1-2H3
InChIKeyRIONVXPCPRPZHL-UHFFFAOYSA-N
XLogP1.91
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-3-(2-methylpyrazol-3-yl)-1-(3,4,5-trifluorophenyl)propan-1-amine
CID 103009605
1-(3,4-difluorophenyl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103009150
1-[4-(difluoromethoxy)phenyl]-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030570
N-methyl-1-(2-methylphenyl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103009289
N-methyl-3-(2-methylpyrazol-3-yl)-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine
CID 103030866
1-(2,3-dihydro-1-benzofuran-5-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030944
N-methyl-3-(2-methylpyrazol-3-yl)-1-(thiadiazol-5-yl)propan-1-amine
CID 103030587
1-(2,4-dimethylphenyl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030633
1-(5-chlorothiophen-2-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030434
1-(4-tert-butylthiadiazol-5-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030592
1-(3-ethylthiophen-2-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030584
N,5-dimethyl-1-(2-methylpyrazol-3-yl)heptan-3-amine
CID 103030518

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine?
The IUPAC name of 1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine (CID 103010290) is 1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for 1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for 1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine is CNC(CCc1ccnn1C)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine?
The InChIKey is RIONVXPCPRPZHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-13-12(10-6-8-16-9-10)4-3-11-5-7-14-15(11)2/h5-9,12-13H,3-4H2,1-2H3.
What are the key properties of 1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine?
1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine has a molecular weight of 219.29 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 103010290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).