4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine

C13H14N4O — CID 63868741

IUPAC4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine
SMILESCOc1ccccc1-c1nc(N)nc(C2CC2)n1
InChIInChI=1S/C13H14N4O/c1-18-10-5-3-2-4-9(10)12-15-11(8-6-7-8)16-13(14)17-12/h2-5,8H,6-7H2,1H3,(H2,14,15,16,17)
InChIKeyPYTBMNVFFMFHEU-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.01
Rot. Bonds3

About 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine

4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine (PubChem CID 63868741) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine
PubChem CID63868741
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine
SMILESCOc1ccccc1-c1nc(N)nc(C2CC2)n1
InChIInChI=1S/C13H14N4O/c1-18-10-5-3-2-4-9(10)12-15-11(8-6-7-8)16-13(14)17-12/h2-5,8H,6-7H2,1H3,(H2,14,15,16,17)
InChIKeyPYTBMNVFFMFHEU-UHFFFAOYSA-N
XLogP2.01
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine
CID 107923218
4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine
CID 63867600
4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine
CID 63867774
4-[4-(2-methoxyphenyl)phenyl]-1,3,5-triazin-2-amine
CID 142791138
4-cyclopropyl-6-(3-fluorophenyl)-1,3,5-triazin-2-amine
CID 63868480
6-cyclopropyl-N-ethyl-2-(2-methoxyphenyl)pyrimidin-4-amine
CID 63354262
6-(2-methoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 15764367
4-cyclohexyl-6-pyridin-2-yl-1,3,5-triazin-2-amine
CID 63867915
4-cyclopropyl-6-(2,3-dihydro-1H-inden-2-yl)-1,3,5-triazin-2-amine
CID 65404523
4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]cyclohexan-1-ol
CID 63346269
5-cyclopropyl-2-(2-methoxyphenyl)pyridin-3-amine
CID 83919445
5-bromo-6-(methoxymethyl)-2-(2-methoxyphenyl)pyrimidin-4-amine
CID 66300553

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine (CID 63868741) is 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine is COc1ccccc1-c1nc(N)nc(C2CC2)n1.
What is the InChIKey of 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine?
The InChIKey is PYTBMNVFFMFHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c1-18-10-5-3-2-4-9(10)12-15-11(8-6-7-8)16-13(14)17-12/h2-5,8H,6-7H2,1H3,(H2,14,15,16,17).
What are the key properties of 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine?
4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine has a molecular weight of 242.28 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 63868741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).