1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine

C10H17N3 — CID 105438423

IUPAC1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine
SMILESCc1nn(C)cc1CCC1(N)CC1
InChIInChI=1S/C10H17N3/c1-8-9(7-13(2)12-8)3-4-10(11)5-6-10/h7H,3-6,11H2,1-2H3
InChIKeyKNUDZTNZEZMLOY-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.15
Rot. Bonds3

About 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine

1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine (PubChem CID 105438423) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine
PubChem CID105438423
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine
SMILESCc1nn(C)cc1CCC1(N)CC1
InChIInChI=1S/C10H17N3/c1-8-9(7-13(2)12-8)3-4-10(11)5-6-10/h7H,3-6,11H2,1-2H3
InChIKeyKNUDZTNZEZMLOY-UHFFFAOYSA-N
XLogP1.15
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 ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1,3-dimethylpyrazol-4-yl)methanamine;hydrate;hydrochloride
CID 86812145
1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine
CID 82611840
N-[2-(1,3-dimethylpyrazol-4-yl)ethyl]-2,2-dimethylpropan-1-amine
CID 115751852
(2S)-1-(1,3-dimethylpyrazol-4-yl)propan-2-amine
CID 40599781
1-(1,3-dimethylpyrazol-4-yl)propan-2-amine
CID 19585896
1,3-dimethyl-4-[2-(2-methylphenyl)ethyl]pyrazole;ethane
CID 91413155
1-[2-(2,4-difluoro-5-methylphenyl)ethyl]cyclopropan-1-amine
CID 105464943
4-(azetidin-1-ylmethyl)-1,3-dimethylpyrazole
CID 130652971
3-(1,3-dimethylpyrazol-4-yl)-N-[(1-hydroxycyclopentyl)methyl]propanamide
CID 111378224
N-[2-(1,3-dimethylpyrazol-4-yl)ethyl]thiolan-3-amine
CID 115895157
1-[(1,3-dimethylpyrazol-4-yl)methyl]piperidine
CID 131703772
1-[2-(2-ethyl-1-methylimidazol-4-yl)ethyl]cyclopropan-1-amine
CID 105447644

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine (CID 105438423) is 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine is Cc1nn(C)cc1CCC1(N)CC1.
What is the InChIKey of 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine?
The InChIKey is KNUDZTNZEZMLOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8-9(7-13(2)12-8)3-4-10(11)5-6-10/h7H,3-6,11H2,1-2H3.
What are the key properties of 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine?
1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine has a molecular weight of 179.27 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105438423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).