6-methyl-1,4-dihydropyrimidin-5-amine

C5H9N3 — CID 142030297

IUPAC6-methyl-1,4-dihydropyrimidin-5-amine
SMILESCC1=C(N)CN=CN1
InChIInChI=1S/C5H9N3/c1-4-5(6)2-7-3-8-4/h3H,2,6H2,1H3,(H,7,8)
InChIKeyJMQRCQPAABGWHJ-UHFFFAOYSA-N
MW111.15 g/mol
LogP-0.19
Rot. Bonds

About 6-methyl-1,4-dihydropyrimidin-5-amine

6-methyl-1,4-dihydropyrimidin-5-amine (PubChem CID 142030297) has the molecular formula C5H9N3 and a molecular weight of 111.15 g/mol. Its IUPAC name is 6-methyl-1,4-dihydropyrimidin-5-amine.

Molecular Properties

Compound Name6-methyl-1,4-dihydropyrimidin-5-amine
PubChem CID142030297
Molecular FormulaC5H9N3
Molecular Weight111.15 g/mol
Exact Mass111.08
IUPAC Name6-methyl-1,4-dihydropyrimidin-5-amine
SMILESCC1=C(N)CN=CN1
InChIInChI=1S/C5H9N3/c1-4-5(6)2-7-3-8-4/h3H,2,6H2,1H3,(H,7,8)
InChIKeyJMQRCQPAABGWHJ-UHFFFAOYSA-N
XLogP-0.19
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.15
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(Z)-3-fluorobut-2-en-2-yl]-N'-methylmethanimidamide
CID 123336063
5-amino-6-methylpyrimidine-4(1H)-thione
CID 3887703
6-Methyl-1,4-dihydropyrimidine
CID 19748724
5,6-Dimethyl-1,4-dihydropyrimidine
CID 58863324
N,6-dimethyl-1,4-dihydropyrimidin-5-amine
CID 89418734
N'-methyl-N-(3-methylbut-2-en-2-yl)methanimidamide
CID 90315791
N,6-dimethyl-1,4-dihydropyrimidin-4-amine
CID 90452821
5,6-Dimethyl-1,4-dihydropyrimidin-4-amine
CID 90453936
6-Methyl-1,4-dihydropyrimidin-4-amine
CID 90454007
5,6-Dimethyl-1,4-dihydropyrimidine;ethane
CID 91034579
5-(ethylamino)-6-methyl-1H-pyrimidine-4-thione
CID 117913523
N,2,6-trimethyl-1,4-dihydropyrimidin-5-amine
CID 118422994

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1,4-dihydropyrimidin-5-amine?
The IUPAC name of 6-methyl-1,4-dihydropyrimidin-5-amine (CID 142030297) is 6-methyl-1,4-dihydropyrimidin-5-amine.
What is the SMILES notation for 6-methyl-1,4-dihydropyrimidin-5-amine?
The canonical SMILES for 6-methyl-1,4-dihydropyrimidin-5-amine is CC1=C(N)CN=CN1.
What is the InChIKey of 6-methyl-1,4-dihydropyrimidin-5-amine?
The InChIKey is JMQRCQPAABGWHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3/c1-4-5(6)2-7-3-8-4/h3H,2,6H2,1H3,(H,7,8).
What are the key properties of 6-methyl-1,4-dihydropyrimidin-5-amine?
6-methyl-1,4-dihydropyrimidin-5-amine has a molecular weight of 111.15 g/mol, XLogP of -0.19, 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-dihydropyrimidin-5-amine is sourced from PubChem (CID 142030297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).