(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine

C7H12N4 — CID 62720360

IUPAC(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine
SMILESCn1nc(C2CC2)nc1CN
InChIInChI=1S/C7H12N4/c1-11-6(4-8)9-7(10-11)5-2-3-5/h5H,2-4,8H2,1H3
InChIKeyFNMXKIOFMCGDMH-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.15
Rot. Bonds2

About (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine

(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine (PubChem CID 62720360) has the molecular formula C7H12N4 and a molecular weight of 152.20 g/mol. Its IUPAC name is (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine.

Molecular Properties

Compound Name(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine
PubChem CID62720360
Molecular FormulaC7H12N4
Molecular Weight152.20 g/mol
Exact Mass152.11
IUPAC Name(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine
SMILESCn1nc(C2CC2)nc1CN
InChIInChI=1S/C7H12N4/c1-11-6(4-8)9-7(10-11)5-2-3-5/h5H,2-4,8H2,1H3
InChIKeyFNMXKIOFMCGDMH-UHFFFAOYSA-N
XLogP0.15
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)hexan-1-amine
CID 62721244
N-[(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methyl]propan-1-amine
CID 62720716
2-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)-N-ethylethanamine
CID 62720706
2-(5-cyclohexyl-2-methyl-1,2,4-triazol-3-yl)acetic acid
CID 62722916
2-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)propan-1-amine
CID 62720886
5-[4-(aminomethyl)cyclohexyl]-2-methyl-1,2,4-triazol-3-amine
CID 104605683
butan-2-yl 2-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)acetate
CID 167752619
4-[(5-cyclohexyl-2-methyl-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-amine
CID 62721471
4-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)-3-methylbutanoic acid
CID 62941672
1-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)pentan-1-amine
CID 62720541
3-cyclopropyl-1,5-diethyl-1,2,4-triazole
CID 134468971
(5S)-1,4-bis[(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methyl]-2,2,5-trimethylpiperazine
CID 164638861

Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine?
The IUPAC name of (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine (CID 62720360) is (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine.
What is the SMILES notation for (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine?
The canonical SMILES for (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine is Cn1nc(C2CC2)nc1CN.
What is the InChIKey of (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine?
The InChIKey is FNMXKIOFMCGDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4/c1-11-6(4-8)9-7(10-11)5-2-3-5/h5H,2-4,8H2,1H3.
What are the key properties of (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine?
(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine has a molecular weight of 152.20 g/mol, XLogP of 0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)methanamine is sourced from PubChem (CID 62720360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).