(2R)-2-amino-5-(diethylamino)pentan-1-ol

C9H22N2O — CID 131859240

IUPAC(2R)-2-amino-5-(diethylamino)pentan-1-ol
SMILESCCN(CC)CCC[C@@H](N)CO
InChIInChI=1S/C9H22N2O/c1-3-11(4-2)7-5-6-9(10)8-12/h9,12H,3-8,10H2,1-2H3/t9-/m1/s1
InChIKeyNTVOWDUSWRAYEH-SECBINFHSA-N
MW174.29 g/mol
LogP0.43
Rot. Bonds7

About (2R)-2-amino-5-(diethylamino)pentan-1-ol

(2R)-2-amino-5-(diethylamino)pentan-1-ol (PubChem CID 131859240) has the molecular formula C9H22N2O and a molecular weight of 174.29 g/mol. Its IUPAC name is (2R)-2-amino-5-(diethylamino)pentan-1-ol.

Molecular Properties

Compound Name(2R)-2-amino-5-(diethylamino)pentan-1-ol
PubChem CID131859240
Molecular FormulaC9H22N2O
Molecular Weight174.29 g/mol
Exact Mass174.17
IUPAC Name(2R)-2-amino-5-(diethylamino)pentan-1-ol
SMILESCCN(CC)CCC[C@@H](N)CO
InChIInChI=1S/C9H22N2O/c1-3-11(4-2)7-5-6-9(10)8-12/h9,12H,3-8,10H2,1-2H3/t9-/m1/s1
InChIKeyNTVOWDUSWRAYEH-SECBINFHSA-N
XLogP0.43
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,1-N-diethylhexane-1,4-diamine
CID 86612309
2-amino-3-(diethylamino)propan-1-ol
CID 57209208
2-amino-4-[ethyl(2-methylpropyl)amino]butan-1-ol
CID 64797844
2-aminononadecan-1-ol
CID 87201322
(2S)-2-aminoundecan-1-ol
CID 98129192
2,7-diaminononan-1-ol
CID 141295191
6-(diethylamino)hexane-1,2-diol
CID 18995566
(3R)-6-(diethylamino)-3-ethylhexan-1-ol
CID 118889911
(2S)-7-(diethylamino)-2-propylheptan-1-ol
CID 118889803
1-cyclopropyl-N',N'-diethylbutane-1,4-diamine;dihydrochloride
CID 69456061
3-[3-(diethylamino)propyl]pentadecan-1-ol
CID 118181955
6-[6-(diethylamino)hexyl-ethylamino]hexan-1-ol
CID 125481029

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-5-(diethylamino)pentan-1-ol?
The IUPAC name of (2R)-2-amino-5-(diethylamino)pentan-1-ol (CID 131859240) is (2R)-2-amino-5-(diethylamino)pentan-1-ol.
What is the SMILES notation for (2R)-2-amino-5-(diethylamino)pentan-1-ol?
The canonical SMILES for (2R)-2-amino-5-(diethylamino)pentan-1-ol is CCN(CC)CCC[C@@H](N)CO.
What is the InChIKey of (2R)-2-amino-5-(diethylamino)pentan-1-ol?
The InChIKey is NTVOWDUSWRAYEH-SECBINFHSA-N. The full InChI is InChI=1S/C9H22N2O/c1-3-11(4-2)7-5-6-9(10)8-12/h9,12H,3-8,10H2,1-2H3/t9-/m1/s1.
What are the key properties of (2R)-2-amino-5-(diethylamino)pentan-1-ol?
(2R)-2-amino-5-(diethylamino)pentan-1-ol has a molecular weight of 174.29 g/mol, XLogP of 0.43, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-5-(diethylamino)pentan-1-ol is sourced from PubChem (CID 131859240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).