1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine

C10H17N3 — CID 115761680

IUPAC1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine
SMILESCCn1nccc1CNCC1CC1
InChIInChI=1S/C10H17N3/c1-2-13-10(5-6-12-13)8-11-7-9-3-4-9/h5-6,9,11H,2-4,7-8H2,1H3
InChIKeyPHXRYQHBUVHTMC-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.40
Rot. Bonds5

About 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine

1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine (PubChem CID 115761680) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine
PubChem CID115761680
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine
SMILESCCn1nccc1CNCC1CC1
InChIInChI=1S/C10H17N3/c1-2-13-10(5-6-12-13)8-11-7-9-3-4-9/h5-6,9,11H,2-4,7-8H2,1H3
InChIKeyPHXRYQHBUVHTMC-UHFFFAOYSA-N
XLogP1.40
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-[(2-methylpyrazol-3-yl)methyl]methanamine
CID 43663124
N-[(2-ethylpyrazol-3-yl)methyl]-1-[(2S,3R)-2-phenyloxolan-3-yl]methanamine
CID 129005258
1-(2-ethylpyrazol-3-yl)-N-[(2-propylpyrazol-3-yl)methyl]methanamine
CID 19625523
N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxyethanamine;hydrochloride
CID 126964497
N-[(2-methylpyrazol-3-yl)methyl]-1-(thian-4-yl)methanamine
CID 115671236
N-[(2-methylpyrazol-3-yl)methyl]-1-piperidin-4-ylmethanamine
CID 79707316
2-[2-[(2-ethylpyrazol-3-yl)methylamino]ethoxy]ethanol
CID 75525234
2-[(2-ethylpyrazol-3-yl)methylamino]-1-pyrrolidin-1-ylethanone
CID 115761675
N-[(2-ethylpyrazol-3-yl)methyl]-1-methylpiperidin-3-amine
CID 115762067
N-[(2-ethylpyrazol-3-yl)methyl]-1-[(2R,3S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methanamine
CID 128997330
1-(1-ethylpyrrolidin-2-yl)-N-[(2-propylpyrazol-3-yl)methyl]methanamine
CID 114554795
1-(2-ethylpyrazol-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine
CID 104589102

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine?
The IUPAC name of 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine (CID 115761680) is 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine?
The canonical SMILES for 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine is CCn1nccc1CNCC1CC1.
What is the InChIKey of 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine?
The InChIKey is PHXRYQHBUVHTMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-2-13-10(5-6-12-13)8-11-7-9-3-4-9/h5-6,9,11H,2-4,7-8H2,1H3.
What are the key properties of 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine?
1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine has a molecular weight of 179.27 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine is sourced from PubChem (CID 115761680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).