(3S)-7-amino-3-hydroxyheptanamide

C7H16N2O2 — CID 15916893

IUPAC(3S)-7-amino-3-hydroxyheptanamide
SMILESNCCCC[C@H](O)CC(N)=O
InChIInChI=1S/C7H16N2O2/c8-4-2-1-3-6(10)5-7(9)11/h6,10H,1-5,8H2,(H2,9,11)/t6-/m0/s1
InChIKeyJZCFXGYSVUKZCC-LURJTMIESA-N
MW160.22 g/mol
LogP-0.65
Rot. Bonds6

About (3S)-7-amino-3-hydroxyheptanamide

(3S)-7-amino-3-hydroxyheptanamide (PubChem CID 15916893) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is (3S)-7-amino-3-hydroxyheptanamide.

Molecular Properties

Compound Name(3S)-7-amino-3-hydroxyheptanamide
PubChem CID15916893
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC Name(3S)-7-amino-3-hydroxyheptanamide
SMILESNCCCC[C@H](O)CC(N)=O
InChIInChI=1S/C7H16N2O2/c8-4-2-1-3-6(10)5-7(9)11/h6,10H,1-5,8H2,(H2,9,11)/t6-/m0/s1
InChIKeyJZCFXGYSVUKZCC-LURJTMIESA-N
XLogP-0.65
TPSA89.34 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-0.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

8-amino-3-hydroxyoctanamide
CID 22149893
8-amino-3-hydroxyoctanamide;hydrochloride
CID 22149892
(3S)-3,7-diaminoheptanamide
CID 165481888
3,5-dihydroxypentanamide
CID 90721259
(3S)-4-amino-3-hydroxybutanamide
CID 12536775
8-aminooctane-1,4-diol
CID 123424341
8-aminooctan-4-ol
CID 146035755
6-amino-2-hydroxyhexanoic acid
CID 517029
(2S,3R)-2-amino-3-hydroxybutanoic acid;(2S)-2,6-diaminohexanoic acid;(2S)-2,4-diamino-4-oxobutanoic acid
CID 87110947
(4S)-1,4,8-triamino-2-hydroxyoctan-3-one
CID 141236123
1-aminooctacosan-11-ol
CID 172994921
(2R)-7-amino-2-hydroxyheptanoic acid
CID 144842569

Frequently Asked Questions

What is the IUPAC name of (3S)-7-amino-3-hydroxyheptanamide?
The IUPAC name of (3S)-7-amino-3-hydroxyheptanamide (CID 15916893) is (3S)-7-amino-3-hydroxyheptanamide.
What is the SMILES notation for (3S)-7-amino-3-hydroxyheptanamide?
The canonical SMILES for (3S)-7-amino-3-hydroxyheptanamide is NCCCC[C@H](O)CC(N)=O.
What is the InChIKey of (3S)-7-amino-3-hydroxyheptanamide?
The InChIKey is JZCFXGYSVUKZCC-LURJTMIESA-N. The full InChI is InChI=1S/C7H16N2O2/c8-4-2-1-3-6(10)5-7(9)11/h6,10H,1-5,8H2,(H2,9,11)/t6-/m0/s1.
What are the key properties of (3S)-7-amino-3-hydroxyheptanamide?
(3S)-7-amino-3-hydroxyheptanamide has a molecular weight of 160.22 g/mol, XLogP of -0.65, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-7-amino-3-hydroxyheptanamide is sourced from PubChem (CID 15916893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).