2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol

C14H25N3O — CID 64826060

IUPAC2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol
SMILESCNC(C)(CO)CCN(C)CCc1ccncc1
InChIInChI=1S/C14H25N3O/c1-14(12-18,15-2)7-11-17(3)10-6-13-4-8-16-9-5-13/h4-5,8-9,15,18H,6-7,10-12H2,1-3H3
InChIKeySRYKELXKEIJPAK-UHFFFAOYSA-N
MW251.37 g/mol
LogP0.92
Rot. Bonds8

About 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol

2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol (PubChem CID 64826060) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol.

Molecular Properties

Compound Name2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol
PubChem CID64826060
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol
SMILESCNC(C)(CO)CCN(C)CCc1ccncc1
InChIInChI=1S/C14H25N3O/c1-14(12-18,15-2)7-11-17(3)10-6-13-4-8-16-9-5-13/h4-5,8-9,15,18H,6-7,10-12H2,1-3H3
InChIKeySRYKELXKEIJPAK-UHFFFAOYSA-N
XLogP0.92
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-3-[methyl(2-pyridin-4-ylethyl)amino]-2-(propylamino)propan-1-ol
CID 64825661
2-amino-2-methyl-6-[methyl(2-pyridin-4-ylethyl)amino]hexan-1-ol
CID 64825270
2-(ethylamino)-2-methyl-4-[methyl(2-phenylethyl)amino]butan-1-ol
CID 65486202
N-tert-butyl-N'-methyl-N'-(2-pyridin-4-ylethyl)ethane-1,2-diamine
CID 61387145
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
N,2-dimethyl-2-(methylamino)-N-(2-pyridin-4-ylethyl)propanamide
CID 62847427
2,2-dimethyl-5-[methyl(2-pyridin-4-ylethyl)amino]pentanoic acid
CID 65255191
4-[4-hydroxy-3-methyl-3-(methylamino)butyl]phenol
CID 61055515
N-(2-bromoethyl)-N-methyl-2-pyridin-4-ylethanamine
CID 61286935
2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol
CID 64796903
2-methyl-2-[methyl(2-pyridin-4-ylethyl)amino]propanenitrile
CID 82282650

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol?
The IUPAC name of 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol (CID 64826060) is 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol.
What is the SMILES notation for 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol?
The canonical SMILES for 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol is CNC(C)(CO)CCN(C)CCc1ccncc1.
What is the InChIKey of 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol?
The InChIKey is SRYKELXKEIJPAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-14(12-18,15-2)7-11-17(3)10-6-13-4-8-16-9-5-13/h4-5,8-9,15,18H,6-7,10-12H2,1-3H3.
What are the key properties of 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol?
2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol has a molecular weight of 251.37 g/mol, XLogP of 0.92, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(methylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol is sourced from PubChem (CID 64826060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).