cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine

C6H10N4 — CID 155082274

IUPACcis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine
SMILESC[C@@H]1C[C@]1(N)c1cn[nH]n1
InChIInChI=1S/C6H10N4/c1-4-2-6(4,7)5-3-8-10-9-5/h3-4H,2,7H2,1H3,(H,8,9,10)/t4-,6-/m1/s1
InChIKeyYVKOUXQSHFBGME-INEUFUBQSA-N
MW138.17 g/mol
LogP-0.00
Rot. Bonds1

About cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine

cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine (PubChem CID 155082274) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine.

Molecular Properties

Compound Namecis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine
PubChem CID155082274
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Namecis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine
SMILESC[C@@H]1C[C@]1(N)c1cn[nH]n1
InChIInChI=1S/C6H10N4/c1-4-2-6(4,7)5-3-8-10-9-5/h3-4H,2,7H2,1H3,(H,8,9,10)/t4-,6-/m1/s1
InChIKeyYVKOUXQSHFBGME-INEUFUBQSA-N
XLogP-0.00
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine?
The IUPAC name of cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine (CID 155082274) is cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine.
What is the SMILES notation for cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine?
The canonical SMILES for cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine is C[C@@H]1C[C@]1(N)c1cn[nH]n1.
What is the InChIKey of cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine?
The InChIKey is YVKOUXQSHFBGME-INEUFUBQSA-N. The full InChI is InChI=1S/C6H10N4/c1-4-2-6(4,7)5-3-8-10-9-5/h3-4H,2,7H2,1H3,(H,8,9,10)/t4-,6-/m1/s1.
What are the key properties of cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine?
cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine has a molecular weight of 138.17 g/mol, XLogP of -0.00, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-2-methyl-1-(2H-triazol-4-yl)cyclopropan-1-amine is sourced from PubChem (CID 155082274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).