N-(1-hydroxyoctadecan-2-yl)formamide

C19H39NO2 — CID 15354101

IUPACN-(1-hydroxyoctadecan-2-yl)formamide
SMILESCCCCCCCCCCCCCCCCC(CO)NC=O
InChIInChI=1S/C19H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(17-21)20-18-22/h18-19,21H,2-17H2,1H3,(H,20,22)
InChIKeyXVYMLTBSBKXFJN-UHFFFAOYSA-N
MW313.53 g/mol
LogP4.96
Rot. Bonds18

About N-(1-hydroxyoctadecan-2-yl)formamide

N-(1-hydroxyoctadecan-2-yl)formamide (PubChem CID 15354101) has the molecular formula C19H39NO2 and a molecular weight of 313.53 g/mol. Its IUPAC name is N-(1-hydroxyoctadecan-2-yl)formamide.

Molecular Properties

Compound NameN-(1-hydroxyoctadecan-2-yl)formamide
PubChem CID15354101
Molecular FormulaC19H39NO2
Molecular Weight313.53 g/mol
Exact Mass313.30
IUPAC NameN-(1-hydroxyoctadecan-2-yl)formamide
SMILESCCCCCCCCCCCCCCCCC(CO)NC=O
InChIInChI=1S/C19H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(17-21)20-18-22/h18-19,21H,2-17H2,1H3,(H,20,22)
InChIKeyXVYMLTBSBKXFJN-UHFFFAOYSA-N
XLogP4.96
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.53
LogP ≤ 54.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(1-hydroxyhexan-2-yl)formamide
CID 91256811
N-nonan-4-ylformamide
CID 144801924
2-(methylamino)hexadecan-1-ol
CID 118696061
2-(ethylamino)nonan-1-ol
CID 61050713
N-octan-4-ylformamide
CID 22178839
N-[(2R)-1-hydroxybutan-2-yl]formamide
CID 55286549
N-(1-hydroxyhexyl)formamide
CID 54387531
N-[(2R)-octan-2-yl]formamide
CID 5478865
2-(2-hydroxyethylamino)hexadecan-1-ol
CID 87123579
N-[(2R)-1-hydroxyicosan-2-yl]-12-oxotricosanamide
CID 54249823
N-[(2S)-1-hydroxyoctadecan-2-yl]-31-oxotetratetracontanamide
CID 57043708
N-[(2S)-1-hydroxyoctadecan-2-yl]-31-oxohexatetracontanamide
CID 57005666

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxyoctadecan-2-yl)formamide?
The IUPAC name of N-(1-hydroxyoctadecan-2-yl)formamide (CID 15354101) is N-(1-hydroxyoctadecan-2-yl)formamide.
What is the SMILES notation for N-(1-hydroxyoctadecan-2-yl)formamide?
The canonical SMILES for N-(1-hydroxyoctadecan-2-yl)formamide is CCCCCCCCCCCCCCCCC(CO)NC=O.
What is the InChIKey of N-(1-hydroxyoctadecan-2-yl)formamide?
The InChIKey is XVYMLTBSBKXFJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(17-21)20-18-22/h18-19,21H,2-17H2,1H3,(H,20,22).
What are the key properties of N-(1-hydroxyoctadecan-2-yl)formamide?
N-(1-hydroxyoctadecan-2-yl)formamide has a molecular weight of 313.53 g/mol, XLogP of 4.96, 18 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxyoctadecan-2-yl)formamide is sourced from PubChem (CID 15354101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).