2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine

C10H17N3 — CID 130527432

IUPAC2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine
SMILESCc1cnn(C)c1C(N)CC1CC1
InChIInChI=1S/C10H17N3/c1-7-6-12-13(2)10(7)9(11)5-8-3-4-8/h6,8-9H,3-5,11H2,1-2H3
InChIKeyXEGBXAPWEJAUKS-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.53
Rot. Bonds3

About 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine

2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine (PubChem CID 130527432) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine
PubChem CID130527432
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine
SMILESCc1cnn(C)c1C(N)CC1CC1
InChIInChI=1S/C10H17N3/c1-7-6-12-13(2)10(7)9(11)5-8-3-4-8/h6,8-9H,3-5,11H2,1-2H3
InChIKeyXEGBXAPWEJAUKS-UHFFFAOYSA-N
XLogP1.53
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-bromo-1-methylpyrazol-5-yl)-2-cyclopentylethanamine
CID 105054241
(3R)-3-amino-3-(1,4-dimethylpyrazol-5-yl)propan-1-ol
CID 96739130
(3S)-3-amino-3-(1,4-dimethylpyrazol-5-yl)propanamide
CID 131209567
(1S)-1-(1,4-dimethylpyrazol-5-yl)ethanamine
CID 96637321
(1R)-1-(1,4-dimethylpyrazol-5-yl)ethanamine
CID 96637320
(1,4-dimethylpyrazol-5-yl)-[(1R,2R)-2-ethylcyclopropyl]methanamine
CID 130775622
2-(1,1-dioxothiolan-3-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 105186241
(1,4-dimethylpyrazol-5-yl)-spiro[2.2]pentan-2-ylmethanamine
CID 164650801
2-cyclopropyl-1-(4-methylphenyl)ethanamine
CID 22649613
(1,4-dimethylpyrazol-5-yl)-(3-ethyl-1,4-dithian-2-yl)methanamine
CID 112742343
2-(2,4-dichlorophenyl)-1-(1,4-dimethylpyrazol-5-yl)ethanamine
CID 112742305
(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114655202

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine?
The IUPAC name of 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine (CID 130527432) is 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine?
The canonical SMILES for 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine is Cc1cnn(C)c1C(N)CC1CC1.
What is the InChIKey of 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine?
The InChIKey is XEGBXAPWEJAUKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-7-6-12-13(2)10(7)9(11)5-8-3-4-8/h6,8-9H,3-5,11H2,1-2H3.
What are the key properties of 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine?
2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine has a molecular weight of 179.27 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(1,4-dimethylpyrazol-5-yl)ethanamine is sourced from PubChem (CID 130527432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).