CID 170516792

C5H10NO2 — CID 170516792

IUPAC—
SMILES[NH][C@@H]1CCOC[C@H]1O
InChIInChI=1S/C5H10NO2/c6-4-1-2-8-3-5(4)7/h4-7H,1-3H2/t4-,5-/m1/s1
InChIKeyQTFCGELHYWMIRB-RFZPGFLSSA-N
MW116.14 g/mol
LogP-0.58
Rot. Bonds

About CID 170516792

CID 170516792 (PubChem CID 170516792) has the molecular formula C5H10NO2 and a molecular weight of 116.14 g/mol.

Molecular Properties

Compound NameCID 170516792
PubChem CID170516792
Molecular FormulaC5H10NO2
Molecular Weight116.14 g/mol
Exact Mass116.07
IUPAC Name—
SMILES[NH][C@@H]1CCOC[C@H]1O
InChIInChI=1S/C5H10NO2/c6-4-1-2-8-3-5(4)7/h4-7H,1-3H2/t4-,5-/m1/s1
InChIKeyQTFCGELHYWMIRB-RFZPGFLSSA-N
XLogP-0.58
TPSA53.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.14
LogP ≤ 5-0.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze CID 170516792 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4R)-3-hydroxyoxane-4-carboxylic acid
CID 156677456
(3S,4R)-4-(methylamino)oxan-3-ol
CID 68677504
(3R,4R)-oxocane-3,4-diol
CID 158919848
(3R)-oxolan-3-ol;hydrochloride
CID 101043602
(3R,4S)-4-prop-1-en-2-yloxan-3-ol
CID 14982330
3-(oxolan-3-yl)oxan-4-ol
CID 106471116
ethane;(3R)-oxolan-3-ol
CID 145226146
3-(methylamino)oxan-4-ol
CID 55287171
(1R,6R,7S)-3-oxabicyclo[4.1.0]heptan-7-ol
CID 178200312
4-aminooxocan-3-ol
CID 20775089
oxolan-3-ol;propane
CID 144858845
1,2,3,3a,4,6,7,7a-octahydropyrano[4,3-c]pyrazole;hydrochloride
CID 170905962

Frequently Asked Questions

What is the IUPAC name of CID 170516792?
The IUPAC name of CID 170516792 (CID 170516792) is not available.
What is the SMILES notation for CID 170516792?
The canonical SMILES for CID 170516792 is [NH][C@@H]1CCOC[C@H]1O.
What is the InChIKey of CID 170516792?
The InChIKey is QTFCGELHYWMIRB-RFZPGFLSSA-N. The full InChI is InChI=1S/C5H10NO2/c6-4-1-2-8-3-5(4)7/h4-7H,1-3H2/t4-,5-/m1/s1.
What are the key properties of CID 170516792?
CID 170516792 has a molecular weight of 116.14 g/mol, XLogP of -0.58, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170516792 is sourced from PubChem (CID 170516792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).