2,4,5,6-tetraaminohexan-1-ol

C6H18N4O — CID 163608286

IUPAC2,4,5,6-tetraaminohexan-1-ol
SMILESNCC(N)C(N)CC(N)CO
InChIInChI=1S/C6H18N4O/c7-2-6(10)5(9)1-4(8)3-11/h4-6,11H,1-3,7-10H2
InChIKeyHDRRPDJOLABVBB-UHFFFAOYSA-N
MW162.24 g/mol
LogP-2.69
Rot. Bonds5

About 2,4,5,6-tetraaminohexan-1-ol

2,4,5,6-tetraaminohexan-1-ol (PubChem CID 163608286) has the molecular formula C6H18N4O and a molecular weight of 162.24 g/mol. Its IUPAC name is 2,4,5,6-tetraaminohexan-1-ol.

Molecular Properties

Compound Name2,4,5,6-tetraaminohexan-1-ol
PubChem CID163608286
Molecular FormulaC6H18N4O
Molecular Weight162.24 g/mol
Exact Mass162.15
IUPAC Name2,4,5,6-tetraaminohexan-1-ol
SMILESNCC(N)C(N)CC(N)CO
InChIInChI=1S/C6H18N4O/c7-2-6(10)5(9)1-4(8)3-11/h4-6,11H,1-3,7-10H2
InChIKeyHDRRPDJOLABVBB-UHFFFAOYSA-N
XLogP-2.69
TPSA124.31 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 5-2.69
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-amino-4,4-difluorobutan-1-ol
CID 95378166
2-amino-4-methylpentane-1,5-diol
CID 72526972
(2S)-2-amino-4-fluorobutan-1-ol
CID 96551535
2-amino-4-methylhexan-1-ol;hydrochloride
CID 55253854
(3-amino-4-hydroxy-1-phosphonobutyl)phosphonic acid
CID 18757017
3-amino-1-methoxybutane-1,4-diol
CID 143333753
4,5-diamino-2-methylpentan-1-ol;ethane;2-methylpropane
CID 142843711
(2S)-2-amino-4-ethylheptan-1-ol
CID 145497284
(2S)-2-aminobutane-1,4-diol;hydrochloride
CID 91654406
(2S,3S,5S,6S)-2,6-diaminoheptane-1,3,5,7-tetrol
CID 46884294
2-aminopropan-1-ol;hydrofluoride
CID 22617394
(2S)-4-amino-3-[(1S)-1-[(2R,5S)-3,5-diamino-1-hydroxyheptan-2-yl]oxy-2-hydroxyethoxy]butane-1,2-diol
CID 89285463

Frequently Asked Questions

What is the IUPAC name of 2,4,5,6-tetraaminohexan-1-ol?
The IUPAC name of 2,4,5,6-tetraaminohexan-1-ol (CID 163608286) is 2,4,5,6-tetraaminohexan-1-ol.
What is the SMILES notation for 2,4,5,6-tetraaminohexan-1-ol?
The canonical SMILES for 2,4,5,6-tetraaminohexan-1-ol is NCC(N)C(N)CC(N)CO.
What is the InChIKey of 2,4,5,6-tetraaminohexan-1-ol?
The InChIKey is HDRRPDJOLABVBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18N4O/c7-2-6(10)5(9)1-4(8)3-11/h4-6,11H,1-3,7-10H2.
What are the key properties of 2,4,5,6-tetraaminohexan-1-ol?
2,4,5,6-tetraaminohexan-1-ol has a molecular weight of 162.24 g/mol, XLogP of -2.69, 5 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5,6-tetraaminohexan-1-ol is sourced from PubChem (CID 163608286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).