3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine

C12H21N3 — CID 105157885

IUPAC3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine
SMILESCNC(CCC1CC1)c1cc(C)nn1C
InChIInChI=1S/C12H21N3/c1-9-8-12(15(3)14-9)11(13-2)7-6-10-4-5-10/h8,10-11,13H,4-7H2,1-3H3
InChIKeyXXNMKYMSKVSMKH-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.18
Rot. Bonds5

About 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine

3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine (PubChem CID 105157885) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine
PubChem CID105157885
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine
SMILESCNC(CCC1CC1)c1cc(C)nn1C
InChIInChI=1S/C12H21N3/c1-9-8-12(15(3)14-9)11(13-2)7-6-10-4-5-10/h8,10-11,13H,4-7H2,1-3H3
InChIKeyXXNMKYMSKVSMKH-UHFFFAOYSA-N
XLogP2.18
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclohexyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine
CID 114192965
1-(2,5-dimethylpyrazol-3-yl)-N-methylpentan-1-amine
CID 105125646
1-(2,5-dimethylpyrazol-3-yl)-N-methylheptan-1-amine
CID 105126365
1-(2,5-dimethylpyrazol-3-yl)-4-methoxy-N-methylbutan-1-amine
CID 105190294
1-(2,5-dimethylpyrazol-3-yl)-N,3-dimethylbutan-1-amine
CID 112709780
[2-cyclopentyl-1-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105299111
3-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-methylpropan-1-amine
CID 105157733
1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 105147665
2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(2,5-dimethylpyrazol-3-yl)-N-methylethanamine
CID 105180408
[1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine
CID 105313929
1-(4-bromo-3,5-dimethylphenyl)-3-cyclopropyl-N-methylpropan-1-amine
CID 114330463
(2,5-dimethylpyrazol-3-yl)-(4-ethylcyclohexyl)methanol
CID 105103730

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine?
The IUPAC name of 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine (CID 105157885) is 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine?
The canonical SMILES for 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine is CNC(CCC1CC1)c1cc(C)nn1C.
What is the InChIKey of 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine?
The InChIKey is XXNMKYMSKVSMKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-9-8-12(15(3)14-9)11(13-2)7-6-10-4-5-10/h8,10-11,13H,4-7H2,1-3H3.
What are the key properties of 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine?
3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 105157885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).