2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol

C15H27N3O — CID 64825270

IUPAC2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol
SMILESCN(CCCCC(C)(N)CO)CCc1ccncc1
InChIInChI=1S/C15H27N3O/c1-15(16,13-19)8-3-4-11-18(2)12-7-14-5-9-17-10-6-14/h5-6,9-10,19H,3-4,7-8,11-13,16H2,1-2H3
InChIKeySLECPFJGRBPWNW-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.44
Rot. Bonds9

About 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol

2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol (PubChem CID 64825270) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol.

Molecular Properties

Compound Name2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol
PubChem CID64825270
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol
SMILESCN(CCCCC(C)(N)CO)CCc1ccncc1
InChIInChI=1S/C15H27N3O/c1-15(16,13-19)8-3-4-11-18(2)12-7-14-5-9-17-10-6-14/h5-6,9-10,19H,3-4,7-8,11-13,16H2,1-2H3
InChIKeySLECPFJGRBPWNW-UHFFFAOYSA-N
XLogP1.44
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.44
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-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol
CID 64826060
2,2-dimethyl-5-[methyl(2-pyridin-4-ylethyl)amino]pentanoic acid
CID 65255191
3-chloro-N-methyl-N-(2-pyridin-4-ylethyl)propan-1-amine
CID 61286728
4,4-dimethyl-1-[methyl(2-pyridin-4-ylethyl)amino]pentan-3-one
CID 62624763
hydrazinyl 3-[methyl(2-pyridin-4-ylethyl)amino]propanoate
CID 66339679
2-amino-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol
CID 64825859
N-tert-butyl-N'-methyl-N'-(2-pyridin-4-ylethyl)ethane-1,2-diamine
CID 61387145
N-methyl-3-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-pyridin-4-ylethyl)propanamide
CID 109025999
2-ethyl-1-N-methyl-1-N-(2-pyridin-4-ylethyl)butane-1,2-diamine
CID 79812656
N-(2-bromoethyl)-N-methyl-2-pyridin-4-ylethanamine
CID 61286935
2,2-dimethyl-6-[methyl(pyridin-4-ylmethyl)amino]hexanoic acid
CID 106713922
2-methyl-3-[methyl(2-pyridin-4-ylethyl)amino]-2-(propylamino)propan-1-ol
CID 64825661

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol?
The IUPAC name of 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol (CID 64825270) is 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol.
What is the SMILES notation for 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol?
The canonical SMILES for 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol is CN(CCCCC(C)(N)CO)CCc1ccncc1.
What is the InChIKey of 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol?
The InChIKey is SLECPFJGRBPWNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-15(16,13-19)8-3-4-11-18(2)12-7-14-5-9-17-10-6-14/h5-6,9-10,19H,3-4,7-8,11-13,16H2,1-2H3.
What are the key properties of 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol?
2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol has a molecular weight of 265.40 g/mol, XLogP of 1.44, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol is sourced from PubChem (CID 64825270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).