2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine

C12H21N3 — CID 115858181

IUPAC2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine
SMILESCCn1nccc1C(NC)C(C)C1CC1
InChIInChI=1S/C12H21N3/c1-4-15-11(7-8-14-15)12(13-3)9(2)10-5-6-10/h7-10,12-13H,4-6H2,1-3H3
InChIKeyYLSADEXMTMWLPI-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.21
Rot. Bonds5

About 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine

2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine (PubChem CID 115858181) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine
PubChem CID115858181
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine
SMILESCCn1nccc1C(NC)C(C)C1CC1
InChIInChI=1S/C12H21N3/c1-4-15-11(7-8-14-15)12(13-3)9(2)10-5-6-10/h7-10,12-13H,4-6H2,1-3H3
InChIKeyYLSADEXMTMWLPI-UHFFFAOYSA-N
XLogP2.21
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 ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-2-methoxy-N-methylethanamine
CID 116722271
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CID 65423027
1-cyclopentyl-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 63976376
1-(7-bicyclo[4.1.0]heptanyl)-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 115857909
1-cyclopropyl-2-(2-ethylpyrazol-3-yl)ethane-1,2-diol
CID 103456908
1-(2-ethylpyrazol-3-yl)-N-methyl-2-phenylbutan-1-amine
CID 115858001
cyclooctyl-(2-ethylpyrazol-3-yl)methanamine
CID 80604016
2-cyclohexyl-2-ethoxy-N-ethyl-1-(2-ethylpyrazol-3-yl)ethanamine
CID 116772422
2-cyclopropyl-1-(1-ethylpyrazol-4-yl)-N-methylpropan-1-amine
CID 115816197
1-(2,3-dihydro-1H-inden-2-yl)-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 65410721
[1-(2-ethylpyrazol-3-yl)-2,3-dimethylbutyl]hydrazine
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N-ethyl-1-(2-ethylpyrazol-3-yl)-2,3-dimethylbutan-1-amine
CID 115858314

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine?
The IUPAC name of 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine (CID 115858181) is 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine?
The canonical SMILES for 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine is CCn1nccc1C(NC)C(C)C1CC1.
What is the InChIKey of 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine?
The InChIKey is YLSADEXMTMWLPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-4-15-11(7-8-14-15)12(13-3)9(2)10-5-6-10/h7-10,12-13H,4-6H2,1-3H3.
What are the key properties of 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine?
2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2-ethylpyrazol-3-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 115858181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).