1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol

C14H25N3O — CID 64819411

IUPAC1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol
SMILESCN(CCCC(C)(O)CN)CCc1ccccn1
InChIInChI=1S/C14H25N3O/c1-14(18,12-15)8-5-10-17(2)11-7-13-6-3-4-9-16-13/h3-4,6,9,18H,5,7-8,10-12,15H2,1-2H3
InChIKeyKRTQLRWOQJYIRE-UHFFFAOYSA-N
MW251.37 g/mol
LogP1.05
Rot. Bonds8

About 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol

1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol (PubChem CID 64819411) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol.

Molecular Properties

Compound Name1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol
PubChem CID64819411
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol
SMILESCN(CCCC(C)(O)CN)CCc1ccccn1
InChIInChI=1S/C14H25N3O/c1-14(18,12-15)8-5-10-17(2)11-7-13-6-3-4-9-16-13/h3-4,6,9,18H,5,7-8,10-12,15H2,1-2H3
InChIKeyKRTQLRWOQJYIRE-UHFFFAOYSA-N
XLogP1.05
TPSA62.38 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 ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N',2,2-trimethyl-N'-(2-pyridin-2-ylethyl)hexane-1,6-diamine
CID 106707873
3-[methyl(2-pyridin-2-ylethyl)amino]propan-1-ol
CID 43393524
2-methyl-2-(methylamino)-6-[methyl(2-pyridin-2-ylethyl)amino]hexan-1-ol
CID 64796903
N',2,2-trimethyl-N'-(pyridin-2-ylmethyl)pentane-1,5-diamine
CID 65254292
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-tert-butyl-N'-methyl-N'-(2-pyridin-2-ylethyl)pentane-1,5-diamine
CID 62419001
N-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 21307320
3,3-dimethyl-4-[methyl(2-pyridin-2-ylethyl)amino]butan-2-ol
CID 66454768
[1-hydroxy-3-[methyl(4-pyridin-2-ylbutyl)amino]-1-phosphonopropyl]phosphonic acid
CID 19776440
2-ethyl-2-(ethylamino)-5-[methyl(2-pyridin-2-ylethyl)amino]pentanenitrile
CID 106802785

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol?
The IUPAC name of 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol (CID 64819411) is 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol.
What is the SMILES notation for 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol?
The canonical SMILES for 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol is CN(CCCC(C)(O)CN)CCc1ccccn1.
What is the InChIKey of 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol?
The InChIKey is KRTQLRWOQJYIRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-14(18,12-15)8-5-10-17(2)11-7-13-6-3-4-9-16-13/h3-4,6,9,18H,5,7-8,10-12,15H2,1-2H3.
What are the key properties of 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol?
1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol has a molecular weight of 251.37 g/mol, XLogP of 1.05, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-methyl-5-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol is sourced from PubChem (CID 64819411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).