N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine

C15H27N3 — CID 113381270

IUPACN,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESCCc1cc(CNC(C)C)cc(N(CC)CC)n1
InChIInChI=1S/C15H27N3/c1-6-14-9-13(11-16-12(4)5)10-15(17-14)18(7-2)8-3/h9-10,12,16H,6-8,11H2,1-5H3
InChIKeyOKYBEVAGKQOQKD-UHFFFAOYSA-N
MW249.40 g/mol
LogP2.99
Rot. Bonds7

About N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine

N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine (PubChem CID 113381270) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine
PubChem CID113381270
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC NameN,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESCCc1cc(CNC(C)C)cc(N(CC)CC)n1
InChIInChI=1S/C15H27N3/c1-6-14-9-13(11-16-12(4)5)10-15(17-14)18(7-2)8-3/h9-10,12,16H,6-8,11H2,1-5H3
InChIKeyOKYBEVAGKQOQKD-UHFFFAOYSA-N
XLogP2.99
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-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,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine?
The IUPAC name of N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine (CID 113381270) is N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine?
The canonical SMILES for N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine is CCc1cc(CNC(C)C)cc(N(CC)CC)n1.
What is the InChIKey of N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine?
The InChIKey is OKYBEVAGKQOQKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-6-14-9-13(11-16-12(4)5)10-15(17-14)18(7-2)8-3/h9-10,12,16H,6-8,11H2,1-5H3.
What are the key properties of N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine?
N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine has a molecular weight of 249.40 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,6-triethyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 113381270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).