2-methyl-5,6-dihydro-4H-pyrimidin-1-amine

C5H11N3 — CID 142204479

IUPAC2-methyl-5,6-dihydro-4H-pyrimidin-1-amine
SMILESCC1=NCCCN1N
InChIInChI=1S/C5H11N3/c1-5-7-3-2-4-8(5)6/h2-4,6H2,1H3
InChIKeyOIXLOQGCUYZNTC-UHFFFAOYSA-N
MW113.16 g/mol
LogP-0.02
Rot. Bonds

About 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine

2-methyl-5,6-dihydro-4H-pyrimidin-1-amine (PubChem CID 142204479) has the molecular formula C5H11N3 and a molecular weight of 113.16 g/mol. Its IUPAC name is 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine.

Molecular Properties

Compound Name2-methyl-5,6-dihydro-4H-pyrimidin-1-amine
PubChem CID142204479
Molecular FormulaC5H11N3
Molecular Weight113.16 g/mol
Exact Mass113.10
IUPAC Name2-methyl-5,6-dihydro-4H-pyrimidin-1-amine
SMILESCC1=NCCCN1N
InChIInChI=1S/C5H11N3/c1-5-7-3-2-4-8(5)6/h2-4,6H2,1H3
InChIKeyOIXLOQGCUYZNTC-UHFFFAOYSA-N
XLogP-0.02
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

1,2-dimethyl-5,6-dihydro-4H-pyrimidine;dihydroiodide
CID 172820210
2-methyl-1-[2-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)ethyl]-5,6-dihydro-4H-pyrimidine
CID 86023388
1,2-dimethyl-5,6,7,8-tetrahydro-4H-1,3-diazocine
CID 166904539
2,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrimidine
CID 157342676
2-methyl-1-(4-methylphenyl)-5,6-dihydro-4H-pyrimidine
CID 58717201
1-methyl-5,6-dihydro-4H-pyrimidin-2-olate
CID 88533494
N,N-dimethyl-2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepin-6-amine
CID 150582155
[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]methylphosphane
CID 58717196
2,3,4,10-tetrahydropyrimido[1,2-a]azepine
CID 57099276
acetic acid;2,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrimidine
CID 67501262
ethane;1-methyl-4,4a,5,6,7,8-hexahydro-3H-pyrido[1,2-c]pyrimidine
CID 142067445
6-chloro-2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine
CID 139950765

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine?
The IUPAC name of 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine (CID 142204479) is 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine.
What is the SMILES notation for 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine?
The canonical SMILES for 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine is CC1=NCCCN1N.
What is the InChIKey of 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine?
The InChIKey is OIXLOQGCUYZNTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3/c1-5-7-3-2-4-8(5)6/h2-4,6H2,1H3.
What are the key properties of 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine?
2-methyl-5,6-dihydro-4H-pyrimidin-1-amine has a molecular weight of 113.16 g/mol, XLogP of -0.02, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5,6-dihydro-4H-pyrimidin-1-amine is sourced from PubChem (CID 142204479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).