1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine

C12H21N3 — CID 104695065

IUPAC1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine
SMILESCCC(NCCc1ccnn1C)C1CC1
InChIInChI=1S/C12H21N3/c1-3-12(10-4-5-10)13-8-6-11-7-9-14-15(11)2/h7,9-10,12-13H,3-6,8H2,1-2H3
InChIKeyWCSDVAWVWINJQM-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.74
Rot. Bonds6

About 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine

1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine (PubChem CID 104695065) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine
PubChem CID104695065
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine
SMILESCCC(NCCc1ccnn1C)C1CC1
InChIInChI=1S/C12H21N3/c1-3-12(10-4-5-10)13-8-6-11-7-9-14-15(11)2/h7,9-10,12-13H,3-6,8H2,1-2H3
InChIKeyWCSDVAWVWINJQM-UHFFFAOYSA-N
XLogP1.74
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(4-methylcyclohexyl)-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103009722
1-cyclopropyl-N-[(2-methylpyrazol-3-yl)methyl]butan-1-amine
CID 115769814
1-cyclobutyl-N-ethyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103010387
2-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-3-amine
CID 104694997
1-(3-bicyclo[3.1.0]hexanyl)-3-(2-methylpyrazol-3-yl)-N-propylpropan-1-amine
CID 103030501
N-[2-(2-methylpyrazol-3-yl)ethyl]pentan-2-amine
CID 104695080
N-[2-(2-methylpyrazol-3-yl)ethyl]heptan-3-amine
CID 104695096
1-ethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine
CID 104694957
1-(4-tert-butylcyclohexyl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103010665
N-[2-(2-methylpyrazol-3-yl)ethyl]-1-phenylethanamine
CID 113442203
3-(2-methylpyrazol-3-yl)-N-propyl-1-(thian-2-yl)propan-1-amine
CID 103011691
5-(4-chloro-4-cyclopropylbutyl)-1-methylpyrazole
CID 103013956

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine?
The IUPAC name of 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine (CID 104695065) is 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine?
The canonical SMILES for 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine is CCC(NCCc1ccnn1C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine?
The InChIKey is WCSDVAWVWINJQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-3-12(10-4-5-10)13-8-6-11-7-9-14-15(11)2/h7,9-10,12-13H,3-6,8H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine?
1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 1.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propan-1-amine is sourced from PubChem (CID 104695065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).