N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine

C10H17N3 — CID 64665606

IUPACN-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine
SMILESCCNCC(C)Cc1cncnc1
InChIInChI=1S/C10H17N3/c1-3-11-5-9(2)4-10-6-12-8-13-7-10/h6-9,11H,3-5H2,1-2H3
InChIKeyXTVRYURYGRWETQ-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.26
Rot. Bonds5

About N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine

N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine (PubChem CID 64665606) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine
PubChem CID64665606
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine
SMILESCCNCC(C)Cc1cncnc1
InChIInChI=1S/C10H17N3/c1-3-11-5-9(2)4-10-6-12-8-13-7-10/h6-9,11H,3-5H2,1-2H3
InChIKeyXTVRYURYGRWETQ-UHFFFAOYSA-N
XLogP1.26
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-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-2-methyl-3-pyrimidin-5-ylpropan-1-amine?
The IUPAC name of N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine (CID 64665606) is N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine is CCNCC(C)Cc1cncnc1.
What is the InChIKey of N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine?
The InChIKey is XTVRYURYGRWETQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-3-11-5-9(2)4-10-6-12-8-13-7-10/h6-9,11H,3-5H2,1-2H3.
What are the key properties of N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine?
N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine has a molecular weight of 179.27 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-3-pyrimidin-5-ylpropan-1-amine is sourced from PubChem (CID 64665606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).