2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide

C14H24N4O — CID 178172548

IUPAC2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide
SMILESCN(CCc1ccccn1)C(=O)C(N)CCCCN
InChIInChI=1S/C14H24N4O/c1-18(11-8-12-6-3-5-10-17-12)14(19)13(16)7-2-4-9-15/h3,5-6,10,13H,2,4,7-9,11,15-16H2,1H3
InChIKeyXVOVSHYLJZGEOH-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.54
Rot. Bonds8

About 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide

2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide (PubChem CID 178172548) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide.

Molecular Properties

Compound Name2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide
PubChem CID178172548
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide
SMILESCN(CCc1ccccn1)C(=O)C(N)CCCCN
InChIInChI=1S/C14H24N4O/c1-18(11-8-12-6-3-5-10-17-12)14(19)13(16)7-2-4-9-15/h3,5-6,10,13H,2,4,7-9,11,15-16H2,1H3
InChIKeyXVOVSHYLJZGEOH-UHFFFAOYSA-N
XLogP0.54
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N,3-dimethyl-N-(2-pyridin-2-ylethyl)pentanamide;2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide
CID 178172547
2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 115180171
2-pyridin-2-ylethyl (2S)-2,6-diaminohexanoate
CID 139942518
2-amino-N-methyl-N-(2-pyridin-2-ylethyl)-2-thiophen-2-ylacetamide
CID 115285974
2-amino-4-[methyl(2-pyridin-2-ylethyl)amino]butanoic acid
CID 55144478
methyl 2-[methyl(2-pyridin-2-ylethyl)carbamoyl]butanoate
CID 115187986
3-amino-3-hydroxyimino-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
CID 76926661
ethane;N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 143678158
2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoacetic acid
CID 43445021
N-methyl-N-(2-pyridin-2-ylethyl)-2-pyridin-2-ylsulfanylpropanamide
CID 71973637
2-(3-aminophenyl)-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 106590813
4-amino-N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]pentanamide
CID 120565270

Frequently Asked Questions

What is the IUPAC name of 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide?
The IUPAC name of 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide (CID 178172548) is 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide.
What is the SMILES notation for 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide?
The canonical SMILES for 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide is CN(CCc1ccccn1)C(=O)C(N)CCCCN.
What is the InChIKey of 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide?
The InChIKey is XVOVSHYLJZGEOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-18(11-8-12-6-3-5-10-17-12)14(19)13(16)7-2-4-9-15/h3,5-6,10,13H,2,4,7-9,11,15-16H2,1H3.
What are the key properties of 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide?
2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide has a molecular weight of 264.37 g/mol, XLogP of 0.54, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diamino-N-methyl-N-(2-pyridin-2-ylethyl)hexanamide is sourced from PubChem (CID 178172548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).