1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine

C14H25N3 — CID 64772039

IUPAC1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine
SMILESCCNC(CCc1ccn(C(C)C)n1)C1CC1
InChIInChI=1S/C14H25N3/c1-4-15-14(12-5-6-12)8-7-13-9-10-17(16-13)11(2)3/h9-12,14-15H,4-8H2,1-3H3
InChIKeyJQOQHWPUPWONPR-UHFFFAOYSA-N
MW235.38 g/mol
LogP2.78
Rot. Bonds7

About 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine

1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine (PubChem CID 64772039) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine
PubChem CID64772039
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine
SMILESCCNC(CCc1ccn(C(C)C)n1)C1CC1
InChIInChI=1S/C14H25N3/c1-4-15-14(12-5-6-12)8-7-13-9-10-17(16-13)11(2)3/h9-12,14-15H,4-8H2,1-3H3
InChIKeyJQOQHWPUPWONPR-UHFFFAOYSA-N
XLogP2.78
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-chloro-4-cyclopropylbutyl)-1-propan-2-ylpyrazole
CID 64801928
N-methyl-1-(4-propan-2-ylcyclohexyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 65424963
N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)-3-(thian-4-yl)propan-2-amine
CID 105154970
N-[1-(3-methylcyclopentyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]propan-1-amine
CID 65412777
N-ethyl-1-(4-methylmorpholin-2-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 79093263
2-(1-butan-2-ylpyrazol-3-yl)-N-ethyl-1-(oxan-4-yl)ethanamine
CID 65334393
1-(1-propan-2-ylpyrazol-3-yl)hexan-3-amine
CID 64773654
1-cyclopentyl-N-ethyl-3-pyridin-2-ylpropan-1-amine
CID 105081102
2-methyl-4-(1-propan-2-ylpyrazol-3-yl)butan-1-ol
CID 64801344
1-(1-butan-2-ylpyrazol-3-yl)-N-ethyl-4-methylpentan-3-amine
CID 64783818
N-ethyl-4-methyl-3-[(1-propan-2-ylpyrazol-3-yl)methyl]pentan-2-amine
CID 64771858
1-cyclopropyl-N-ethyl-3-(2-methoxyphenyl)propan-1-amine
CID 63354961

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine?
The IUPAC name of 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine (CID 64772039) is 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine is CCNC(CCc1ccn(C(C)C)n1)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine?
The InChIKey is JQOQHWPUPWONPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-15-14(12-5-6-12)8-7-13-9-10-17(16-13)11(2)3/h9-12,14-15H,4-8H2,1-3H3.
What are the key properties of 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine?
1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine has a molecular weight of 235.38 g/mol, XLogP of 2.78, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 64772039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).