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

C6H13N3 — CID 12052711

IUPAC5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine
SMILESCC1(C)CN=C(N)NC1
InChIInChI=1S/C6H13N3/c1-6(2)3-8-5(7)9-4-6/h3-4H2,1-2H3,(H3,7,8,9)
InChIKeyBILRFUQRWMIDOF-UHFFFAOYSA-N
MW127.19 g/mol
LogP-0.07
Rot. Bonds

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

5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine (PubChem CID 12052711) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is 5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine.

Molecular Properties

Compound Name5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine
PubChem CID12052711
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC Name5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine
SMILESCC1(C)CN=C(N)NC1
InChIInChI=1S/C6H13N3/c1-6(2)3-8-5(7)9-4-6/h3-4H2,1-2H3,(H3,7,8,9)
InChIKeyBILRFUQRWMIDOF-UHFFFAOYSA-N
XLogP-0.07
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine?
The IUPAC name of 5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine (CID 12052711) is 5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine.
What is the SMILES notation for 5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine?
The canonical SMILES for 5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine is CC1(C)CN=C(N)NC1.
What is the InChIKey of 5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine?
The InChIKey is BILRFUQRWMIDOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3/c1-6(2)3-8-5(7)9-4-6/h3-4H2,1-2H3,(H3,7,8,9).
What are the key properties of 5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine?
5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine has a molecular weight of 127.19 g/mol, XLogP of -0.07, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine is sourced from PubChem (CID 12052711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).