N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine

C9H19N3 — CID 21483386

IUPACN,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine
SMILESCN(C)C(C)(C)C1=NCCCN1
InChIInChI=1S/C9H19N3/c1-9(2,12(3)4)8-10-6-5-7-11-8/h5-7H2,1-4H3,(H,10,11)
InChIKeyIPWYWJJNCDKBMD-UHFFFAOYSA-N
MW169.27 g/mol
LogP0.72
Rot. Bonds2

About N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine

N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine (PubChem CID 21483386) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine
PubChem CID21483386
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC NameN,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine
SMILESCN(C)C(C)(C)C1=NCCCN1
InChIInChI=1S/C9H19N3/c1-9(2,12(3)4)8-10-6-5-7-11-8/h5-7H2,1-4H3,(H,10,11)
InChIKeyIPWYWJJNCDKBMD-UHFFFAOYSA-N
XLogP0.72
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine?
The IUPAC name of N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine (CID 21483386) is N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine.
What is the SMILES notation for N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine?
The canonical SMILES for N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine is CN(C)C(C)(C)C1=NCCCN1.
What is the InChIKey of N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine?
The InChIKey is IPWYWJJNCDKBMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3/c1-9(2,12(3)4)8-10-6-5-7-11-8/h5-7H2,1-4H3,(H,10,11).
What are the key properties of N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine?
N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine has a molecular weight of 169.27 g/mol, XLogP of 0.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(1,4,5,6-tetrahydropyrimidin-2-yl)propan-2-amine is sourced from PubChem (CID 21483386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).