N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine

C11H23N3 — CID 129051299

IUPACN,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine
SMILESCC(C)C(C)N(C)C1=NCCCN1C
InChIInChI=1S/C11H23N3/c1-9(2)10(3)14(5)11-12-7-6-8-13(11)4/h9-10H,6-8H2,1-5H3
InChIKeySDGUXNSJDGBTSZ-UHFFFAOYSA-N
MW197.33 g/mol
LogP1.65
Rot. Bonds2

About N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine

N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine (PubChem CID 129051299) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine.

Molecular Properties

Compound NameN,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine
PubChem CID129051299
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC NameN,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine
SMILESCC(C)C(C)N(C)C1=NCCCN1C
InChIInChI=1S/C11H23N3/c1-9(2)10(3)14(5)11-12-7-6-8-13(11)4/h9-10H,6-8H2,1-5H3
InChIKeySDGUXNSJDGBTSZ-UHFFFAOYSA-N
XLogP1.65
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine?
The IUPAC name of N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine (CID 129051299) is N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine.
What is the SMILES notation for N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine?
The canonical SMILES for N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine is CC(C)C(C)N(C)C1=NCCCN1C.
What is the InChIKey of N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine?
The InChIKey is SDGUXNSJDGBTSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-9(2)10(3)14(5)11-12-7-6-8-13(11)4/h9-10H,6-8H2,1-5H3.
What are the key properties of N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine?
N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine has a molecular weight of 197.33 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-(3-methylbutan-2-yl)-5,6-dihydro-4H-pyrimidin-2-amine is sourced from PubChem (CID 129051299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).