6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol

C11H28N2O2 — CID 175340151

IUPAC6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol
SMILESCC(N)CCCC(C)(C)O.CC(O)CN
InChIInChI=1S/C8H19NO.C3H9NO/c1-7(9)5-4-6-8(2,3)10;1-3(5)2-4/h7,10H,4-6,9H2,1-3H3;3,5H,2,4H2,1H3
InChIKeyMYNUCVGJFQDUAU-UHFFFAOYSA-N
MW220.36 g/mol
LogP0.60
Rot. Bonds5

About 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol

6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol (PubChem CID 175340151) has the molecular formula C11H28N2O2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol.

Molecular Properties

Compound Name6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol
PubChem CID175340151
Molecular FormulaC11H28N2O2
Molecular Weight220.36 g/mol
Exact Mass220.22
IUPAC Name6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol
SMILESCC(N)CCCC(C)(C)O.CC(O)CN
InChIInChI=1S/C8H19NO.C3H9NO/c1-7(9)5-4-6-8(2,3)10;1-3(5)2-4/h7,10H,4-6,9H2,1-3H3;3,5H,2,4H2,1H3
InChIKeyMYNUCVGJFQDUAU-UHFFFAOYSA-N
XLogP0.60
TPSA92.50 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 50.60
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

9-amino-2,6-dimethylnonan-2-ol
CID 55254540
6-amino-2-methylheptane-2-thiol
CID 21432614
9-amino-2,2-dimethyldecan-5-one
CID 116610021
2,14-dimethylpentadecane-2,8,14-triol
CID 88582277
(5R)-5-aminohexan-2-ol
CID 144692574
2-amino-5,9-dimethyldecane-1,9-diol;hydrochloride
CID 170893103
6-[3,5-bis(6-amino-2-methylheptan-2-yl)phenyl]-6-methylheptan-2-amine
CID 70151483
(6R)-2,6,8-trimethyl-7-propan-2-ylnonan-2-ol
CID 59038713
docosane-2,21-diamine
CID 150079956
potassium;1-aminopropan-2-ol;hydroxide
CID 175114009
2-amino-2-methylpropane-1,3-diol;1-aminopropan-2-ol
CID 87217898
(4-amino-1-hydroxy-1-phosphonobutyl)phosphonic acid;hexane-1,5-diamine
CID 174676436

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol?
The IUPAC name of 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol (CID 175340151) is 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol.
What is the SMILES notation for 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol?
The canonical SMILES for 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol is CC(N)CCCC(C)(C)O.CC(O)CN.
What is the InChIKey of 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol?
The InChIKey is MYNUCVGJFQDUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO.C3H9NO/c1-7(9)5-4-6-8(2,3)10;1-3(5)2-4/h7,10H,4-6,9H2,1-3H3;3,5H,2,4H2,1H3.
What are the key properties of 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol?
6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol has a molecular weight of 220.36 g/mol, XLogP of 0.60, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-methylheptan-2-ol;1-aminopropan-2-ol is sourced from PubChem (CID 175340151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).