N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine

C13H21N3O — CID 130369631

IUPACN-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine
SMILESCC(C)c1ccnc(NCC2CNCCO2)c1
InChIInChI=1S/C13H21N3O/c1-10(2)11-3-4-15-13(7-11)16-9-12-8-14-5-6-17-12/h3-4,7,10,12,14H,5-6,8-9H2,1-2H3,(H,15,16)
InChIKeyFPJTYDQCVBDOHN-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.61
Rot. Bonds4

About N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine

N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine (PubChem CID 130369631) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound NameN-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine
PubChem CID130369631
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine
SMILESCC(C)c1ccnc(NCC2CNCCO2)c1
InChIInChI=1S/C13H21N3O/c1-10(2)11-3-4-15-13(7-11)16-9-12-8-14-5-6-17-12/h3-4,7,10,12,14H,5-6,8-9H2,1-2H3,(H,15,16)
InChIKeyFPJTYDQCVBDOHN-UHFFFAOYSA-N
XLogP1.61
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-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-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine?
The IUPAC name of N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine (CID 130369631) is N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine.
What is the SMILES notation for N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine?
The canonical SMILES for N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine is CC(C)c1ccnc(NCC2CNCCO2)c1.
What is the InChIKey of N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine?
The InChIKey is FPJTYDQCVBDOHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10(2)11-3-4-15-13(7-11)16-9-12-8-14-5-6-17-12/h3-4,7,10,12,14H,5-6,8-9H2,1-2H3,(H,15,16).
What are the key properties of N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine?
N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine has a molecular weight of 235.33 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(morpholin-2-ylmethyl)-4-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 130369631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).