N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine

C10H23N3S — CID 123464881

IUPACN-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine
SMILESCCS(C)(C)N(C)C1=NCCCN1C
InChIInChI=1S/C10H23N3S/c1-6-14(4,5)13(3)10-11-8-7-9-12(10)2/h6-9H2,1-5H3
InChIKeyDPWMMYZTCXWMPJ-UHFFFAOYSA-N
MW217.38 g/mol
LogP1.61
Rot. Bonds2

About N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine

N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine (PubChem CID 123464881) has the molecular formula C10H23N3S and a molecular weight of 217.38 g/mol. Its IUPAC name is N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine.

Molecular Properties

Compound NameN-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine
PubChem CID123464881
Molecular FormulaC10H23N3S
Molecular Weight217.38 g/mol
Exact Mass217.16
IUPAC NameN-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine
SMILESCCS(C)(C)N(C)C1=NCCCN1C
InChIInChI=1S/C10H23N3S/c1-6-14(4,5)13(3)10-11-8-7-9-12(10)2/h6-9H2,1-5H3
InChIKeyDPWMMYZTCXWMPJ-UHFFFAOYSA-N
XLogP1.61
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.38
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine?
The IUPAC name of N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine (CID 123464881) is N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine.
What is the SMILES notation for N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine?
The canonical SMILES for N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine is CCS(C)(C)N(C)C1=NCCCN1C.
What is the InChIKey of N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine?
The InChIKey is DPWMMYZTCXWMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3S/c1-6-14(4,5)13(3)10-11-8-7-9-12(10)2/h6-9H2,1-5H3.
What are the key properties of N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine?
N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine has a molecular weight of 217.38 g/mol, XLogP of 1.61, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[ethyl(dimethyl)-λ4-sulfanyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine is sourced from PubChem (CID 123464881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).