2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol

C16H29N3O — CID 64796903

IUPAC2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol
SMILESCNC(C)(CO)CCCCN(C)CCc1ccccn1
InChIInChI=1S/C16H29N3O/c1-16(14-20,17-2)10-5-7-12-19(3)13-9-15-8-4-6-11-18-15/h4,6,8,11,17,20H,5,7,9-10,12-14H2,1-3H3
InChIKeyUDJGOKMOXHJWBH-UHFFFAOYSA-N
MW279.43 g/mol
LogP1.70
Rot. Bonds10

About 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol

2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol (PubChem CID 64796903) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol.

Molecular Properties

Compound Name2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol
PubChem CID64796903
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC Name2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol
SMILESCNC(C)(CO)CCCCN(C)CCc1ccccn1
InChIInChI=1S/C16H29N3O/c1-16(14-20,17-2)10-5-7-12-19(3)13-9-15-8-4-6-11-18-15/h4,6,8,11,17,20H,5,7,9-10,12-14H2,1-3H3
InChIKeyUDJGOKMOXHJWBH-UHFFFAOYSA-N
XLogP1.70
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 51.70
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

3-[methyl(2-pyridin-2-ylethyl)amino]propan-1-ol
CID 43393524
N',2,2-trimethyl-N'-(2-pyridin-2-ylethyl)hexane-1,6-diamine
CID 106707873
N-tert-butyl-N'-methyl-N'-(2-pyridin-2-ylethyl)pentane-1,5-diamine
CID 62419001
1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol
CID 64819411
5-chloro-N-methyl-N-(2-pyridin-2-ylethyl)pentan-1-amine
CID 61289139
6-chloro-N-methyl-N-(2-pyridin-2-ylethyl)hexan-1-amine
CID 62229678
4-[methyl(2-pyridin-2-ylethyl)amino]butanehydrazide
CID 63572869
N-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 21307320
[1-hydroxy-3-[methyl(4-pyridin-2-ylbutyl)amino]-1-phosphonopropyl]phosphonic acid
CID 19776440
2-methyl-2-(methylamino)-5-pyridin-2-ylsulfanylpentan-1-ol
CID 64807025
3,3-dimethyl-4-[methyl(2-pyridin-2-ylethyl)amino]butan-2-ol
CID 66454768
2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol
CID 64826060

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol?
The IUPAC name of 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol (CID 64796903) is 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol.
What is the SMILES notation for 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol?
The canonical SMILES for 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol is CNC(C)(CO)CCCCN(C)CCc1ccccn1.
What is the InChIKey of 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol?
The InChIKey is UDJGOKMOXHJWBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-16(14-20,17-2)10-5-7-12-19(3)13-9-15-8-4-6-11-18-15/h4,6,8,11,17,20H,5,7,9-10,12-14H2,1-3H3.
What are the key properties of 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol?
2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol has a molecular weight of 279.43 g/mol, XLogP of 1.70, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol is sourced from PubChem (CID 64796903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).