2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol

C16H36N2O — CID 64827986

IUPAC2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol
SMILESCCCNC(C)(CO)CCCN(C)C(C)CC(C)C
InChIInChI=1S/C16H36N2O/c1-7-10-17-16(5,13-19)9-8-11-18(6)15(4)12-14(2)3/h14-15,17,19H,7-13H2,1-6H3
InChIKeyINBQUIFPAOZYFC-UHFFFAOYSA-N
MW272.48 g/mol
LogP2.88
Rot. Bonds11

About 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol

2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol (PubChem CID 64827986) has the molecular formula C16H36N2O and a molecular weight of 272.48 g/mol. Its IUPAC name is 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol.

Molecular Properties

Compound Name2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol
PubChem CID64827986
Molecular FormulaC16H36N2O
Molecular Weight272.48 g/mol
Exact Mass272.28
IUPAC Name2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol
SMILESCCCNC(C)(CO)CCCN(C)C(C)CC(C)C
InChIInChI=1S/C16H36N2O/c1-7-10-17-16(5,13-19)9-8-11-18(6)15(4)12-14(2)3/h14-15,17,19H,7-13H2,1-6H3
InChIKeyINBQUIFPAOZYFC-UHFFFAOYSA-N
XLogP2.88
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.48
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-5-[methyl(3-methylbutan-2-yl)amino]-2-(propylamino)pentan-1-ol
CID 64796845
2-methyl-5-[methyl(2-methylpropyl)amino]-2-(propylamino)pentan-1-ol
CID 64796336
2-methyl-5-[2-methylpropyl(propan-2-yl)amino]-2-(propylamino)pentan-1-ol
CID 64827398
2-methyl-2-(methylamino)-5-[methyl(pentan-2-yl)amino]pentan-1-ol
CID 64798130
2-methyl-6-[methyl(2-methylbutyl)amino]-2-(propylamino)hexan-1-ol
CID 64798749
6-(dipropylamino)-2-methyl-2-(propylamino)hexan-1-ol
CID 64796522
6-[2,2-dimethylpropyl(methyl)amino]-2-methyl-2-(propylamino)hexan-1-ol
CID 64825383
2-methyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol
CID 64798662
2-methyl-6-(2-methylpropoxy)-2-(propylamino)hexan-1-ol
CID 64802775
5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol
CID 64787636
2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol
CID 64791640
5-(4-methoxy-N-methylanilino)-2-methyl-2-(propylamino)pentan-1-ol
CID 64790140

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol?
The IUPAC name of 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol (CID 64827986) is 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol.
What is the SMILES notation for 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol?
The canonical SMILES for 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol is CCCNC(C)(CO)CCCN(C)C(C)CC(C)C.
What is the InChIKey of 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol?
The InChIKey is INBQUIFPAOZYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36N2O/c1-7-10-17-16(5,13-19)9-8-11-18(6)15(4)12-14(2)3/h14-15,17,19H,7-13H2,1-6H3.
What are the key properties of 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol?
2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol has a molecular weight of 272.48 g/mol, XLogP of 2.88, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[methyl(4-methylpentan-2-yl)amino]-2-(propylamino)pentan-1-ol is sourced from PubChem (CID 64827986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).