[4-(3-azidopropyl)morpholin-2-yl]methanol

C8H16N4O2 — CID 81219129

IUPAC[4-(3-azidopropyl)morpholin-2-yl]methanol
SMILES[N-]=[N+]=NCCCN1CCOC(CO)C1
InChIInChI=1S/C8H16N4O2/c9-11-10-2-1-3-12-4-5-14-8(6-12)7-13/h8,13H,1-7H2
InChIKeySZQXJAQLDSATIC-UHFFFAOYSA-N
MW200.24 g/mol
LogP0.38
Rot. Bonds5

About [4-(3-azidopropyl)morpholin-2-yl]methanol

[4-(3-azidopropyl)morpholin-2-yl]methanol (PubChem CID 81219129) has the molecular formula C8H16N4O2 and a molecular weight of 200.24 g/mol. Its IUPAC name is [4-(3-azidopropyl)morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(3-azidopropyl)morpholin-2-yl]methanol
PubChem CID81219129
Molecular FormulaC8H16N4O2
Molecular Weight200.24 g/mol
Exact Mass200.13
IUPAC Name[4-(3-azidopropyl)morpholin-2-yl]methanol
SMILES[N-]=[N+]=NCCCN1CCOC(CO)C1
InChIInChI=1S/C8H16N4O2/c9-11-10-2-1-3-12-4-5-14-8(6-12)7-13/h8,13H,1-7H2
InChIKeySZQXJAQLDSATIC-UHFFFAOYSA-N
XLogP0.38
TPSA81.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

(4-pent-4-ynylmorpholin-2-yl)methanol
CID 115873222
[4-(3-azidopropyl)-5-methylmorpholin-2-yl]methanol
CID 81219212
ethyl 5-[(2R)-2-(azidomethyl)morpholin-4-yl]pentanoate
CID 59448013
2-(azidomethyl)-4-benzylmorpholine
CID 19848617
[4-[2-(trifluoromethoxy)ethyl]morpholin-2-yl]methanol
CID 81219382
3-[2-(hydroxymethyl)morpholin-4-yl]-1-(4-methylphenyl)propan-1-one
CID 81214433
trifluoro-[[2-(hydroxymethyl)morpholin-4-yl]methyl]boranuide
CID 79016153
(4-prop-2-ynylmorpholin-2-yl)methanol
CID 79833462
1-[1-(3-azidopropyl)pyrrolidin-3-yl]ethanol
CID 112628115
[4-[3-(3-aminophenoxy)propyl]morpholin-2-yl]methanol
CID 81205796
[4-[3-[3-(aminomethyl)phenoxy]propyl]morpholin-2-yl]methanol
CID 81203703
[4-[2-(4-fluorophenyl)sulfanylethyl]morpholin-2-yl]methanol
CID 79841047

Frequently Asked Questions

What is the IUPAC name of [4-(3-azidopropyl)morpholin-2-yl]methanol?
The IUPAC name of [4-(3-azidopropyl)morpholin-2-yl]methanol (CID 81219129) is [4-(3-azidopropyl)morpholin-2-yl]methanol.
What is the SMILES notation for [4-(3-azidopropyl)morpholin-2-yl]methanol?
The canonical SMILES for [4-(3-azidopropyl)morpholin-2-yl]methanol is [N-]=[N+]=NCCCN1CCOC(CO)C1.
What is the InChIKey of [4-(3-azidopropyl)morpholin-2-yl]methanol?
The InChIKey is SZQXJAQLDSATIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4O2/c9-11-10-2-1-3-12-4-5-14-8(6-12)7-13/h8,13H,1-7H2.
What are the key properties of [4-(3-azidopropyl)morpholin-2-yl]methanol?
[4-(3-azidopropyl)morpholin-2-yl]methanol has a molecular weight of 200.24 g/mol, XLogP of 0.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-azidopropyl)morpholin-2-yl]methanol is sourced from PubChem (CID 81219129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).