N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine

C13H23N3 — CID 62587829

IUPACN'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine
SMILESCCN(CCNC(C)C)c1ccc(C)cn1
InChIInChI=1S/C13H23N3/c1-5-16(9-8-14-11(2)3)13-7-6-12(4)10-15-13/h6-7,10-11,14H,5,8-9H2,1-4H3
InChIKeyGZGFEXIGNVXHGB-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.21
Rot. Bonds6

About N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine

N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine (PubChem CID 62587829) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine
PubChem CID62587829
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine
SMILESCCN(CCNC(C)C)c1ccc(C)cn1
InChIInChI=1S/C13H23N3/c1-5-16(9-8-14-11(2)3)13-7-6-12(4)10-15-13/h6-7,10-11,14H,5,8-9H2,1-4H3
InChIKeyGZGFEXIGNVXHGB-UHFFFAOYSA-N
XLogP2.21
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine with MolForge

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

Launch Full Analysis

Related Compounds

N'-ethyl-N'-(4-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine
CID 62587832
3-[ethyl-(5-methyl-2-pyridinyl)amino]-2-methylpropanoic acid
CID 66279259
N-(2-bromoethyl)-5-methyl-N-propylpyridin-2-amine
CID 80674163
N'-ethyl-N'-(3-methylphenyl)-N-propan-2-ylethane-1,2-diamine
CID 20811771
3-[ethyl-[5-[(propan-2-ylamino)methyl]-2-pyridinyl]amino]propan-1-ol
CID 113468825
N'-ethyl-N'-(2-methylphenyl)-N-propan-2-ylethane-1,2-diamine
CID 60843081
N-(5-methyl-2-pyridinyl)-N'-propan-2-ylethane-1,2-diamine
CID 62664659
N-ethyl-5-[(propan-2-ylamino)methyl]-N-propylpyrazin-2-amine
CID 107379089
3-[2-methylpropyl-(5-methyl-2-pyridinyl)amino]propanoic acid
CID 82319305
N'-(3,5-dibromo-2-pyridinyl)-N'-ethyl-N-propan-2-ylethane-1,2-diamine
CID 113413937
N'-(5-chloro-2-pyridinyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine
CID 62585670
N'-ethyl-N-propan-2-yl-N'-thieno[2,3-d]pyrimidin-4-ylethane-1,2-diamine
CID 62588191

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine?
The IUPAC name of N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine (CID 62587829) is N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine is CCN(CCNC(C)C)c1ccc(C)cn1.
What is the InChIKey of N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine?
The InChIKey is GZGFEXIGNVXHGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-5-16(9-8-14-11(2)3)13-7-6-12(4)10-15-13/h6-7,10-11,14H,5,8-9H2,1-4H3.
What are the key properties of N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine?
N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine has a molecular weight of 221.35 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-(5-methyl-2-pyridinyl)-N-propan-2-ylethane-1,2-diamine is sourced from PubChem (CID 62587829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).