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

C7H15NO2 — CID 91256811

IUPACN-(1-hydroxyhexan-2-yl)formamide
SMILESCCCCC(CO)NC=O
InChIInChI=1S/C7H15NO2/c1-2-3-4-7(5-9)8-6-10/h6-7,9H,2-5H2,1H3,(H,8,10)
InChIKeyRKEHUVWKQGIZGV-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.28
Rot. Bonds6

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

N-(1-hydroxyhexan-2-yl)formamide (PubChem CID 91256811) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is N-(1-hydroxyhexan-2-yl)formamide.

Molecular Properties

Compound NameN-(1-hydroxyhexan-2-yl)formamide
PubChem CID91256811
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC NameN-(1-hydroxyhexan-2-yl)formamide
SMILESCCCCC(CO)NC=O
InChIInChI=1S/C7H15NO2/c1-2-3-4-7(5-9)8-6-10/h6-7,9H,2-5H2,1H3,(H,8,10)
InChIKeyRKEHUVWKQGIZGV-UHFFFAOYSA-N
XLogP0.28
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(1-hydroxyoctadecan-2-yl)formamide
CID 15354101
N-octan-4-ylformamide
CID 22178839
N-[(2R)-1-hydroxybutan-2-yl]formamide
CID 55286549
N-nonan-4-ylformamide
CID 144801924
N-heptan-4-ylformamide
CID 14473374
2-(iodoamino)hexan-1-ol
CID 88639223
N-(1-hydroxyhexyl)formamide
CID 54387531
2-(2,2,2-trifluoroethylamino)hexan-1-ol
CID 61352156
N-[1-(methylamino)hexan-3-yl]formamide
CID 142442002
2-(methylamino)hexadecan-1-ol
CID 118696061
2-(ethylamino)nonan-1-ol
CID 61050713
N-(1,3-dihydroxypropan-2-yl)-2-methylhexanamide
CID 154697432

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxyhexan-2-yl)formamide?
The IUPAC name of N-(1-hydroxyhexan-2-yl)formamide (CID 91256811) is N-(1-hydroxyhexan-2-yl)formamide.
What is the SMILES notation for N-(1-hydroxyhexan-2-yl)formamide?
The canonical SMILES for N-(1-hydroxyhexan-2-yl)formamide is CCCCC(CO)NC=O.
What is the InChIKey of N-(1-hydroxyhexan-2-yl)formamide?
The InChIKey is RKEHUVWKQGIZGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-2-3-4-7(5-9)8-6-10/h6-7,9H,2-5H2,1H3,(H,8,10).
What are the key properties of N-(1-hydroxyhexan-2-yl)formamide?
N-(1-hydroxyhexan-2-yl)formamide has a molecular weight of 145.20 g/mol, XLogP of 0.28, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxyhexan-2-yl)formamide is sourced from PubChem (CID 91256811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).