6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride

C5H12ClN3 — CID 23132630

IUPAC6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride
SMILESCC1CCN=C(N)N1.Cl
InChIInChI=1S/C5H11N3.ClH/c1-4-2-3-7-5(6)8-4;/h4H,2-3H2,1H3,(H3,6,7,8);1H
InChIKeyZNOIAHOPHBDPRB-UHFFFAOYSA-N
MW149.62 g/mol
LogP0.10
Rot. Bonds

About 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride

6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride (PubChem CID 23132630) has the molecular formula C5H12ClN3 and a molecular weight of 149.62 g/mol. Its IUPAC name is 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride.

Molecular Properties

Compound Name6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride
PubChem CID23132630
Molecular FormulaC5H12ClN3
Molecular Weight149.62 g/mol
Exact Mass149.07
IUPAC Name6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride
SMILESCC1CCN=C(N)N1.Cl
InChIInChI=1S/C5H11N3.ClH/c1-4-2-3-7-5(6)8-4;/h4H,2-3H2,1H3,(H3,6,7,8);1H
InChIKeyZNOIAHOPHBDPRB-UHFFFAOYSA-N
XLogP0.10
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.62
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride?
The IUPAC name of 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride (CID 23132630) is 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride.
What is the SMILES notation for 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride?
The canonical SMILES for 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride is CC1CCN=C(N)N1.Cl.
What is the InChIKey of 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride?
The InChIKey is ZNOIAHOPHBDPRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3.ClH/c1-4-2-3-7-5(6)8-4;/h4H,2-3H2,1H3,(H3,6,7,8);1H.
What are the key properties of 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride?
6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride has a molecular weight of 149.62 g/mol, XLogP of 0.10, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine;hydrochloride is sourced from PubChem (CID 23132630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).