3-(diethylamino)hexyl carbamate

C11H24N2O2 — CID 88732778

IUPAC3-(diethylamino)hexyl carbamate
SMILESCCCC(CCOC(N)=O)N(CC)CC
InChIInChI=1S/C11H24N2O2/c1-4-7-10(13(5-2)6-3)8-9-15-11(12)14/h10H,4-9H2,1-3H3,(H2,12,14)
InChIKeyRLKKQYJBKVOPES-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.98
Rot. Bonds8

About 3-(diethylamino)hexyl carbamate

3-(diethylamino)hexyl carbamate (PubChem CID 88732778) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 3-(diethylamino)hexyl carbamate.

Molecular Properties

Compound Name3-(diethylamino)hexyl carbamate
PubChem CID88732778
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name3-(diethylamino)hexyl carbamate
SMILESCCCC(CCOC(N)=O)N(CC)CC
InChIInChI=1S/C11H24N2O2/c1-4-7-10(13(5-2)6-3)8-9-15-11(12)14/h10H,4-9H2,1-3H3,(H2,12,14)
InChIKeyRLKKQYJBKVOPES-UHFFFAOYSA-N
XLogP1.98
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-(diethylamino)decyl 2-methylprop-2-enoate
CID 102118085
propyl carbamate;dihydrochloride
CID 87576214
N,N-diethyltridecan-4-amine
CID 159822270
ethyl 2-[(2-amino-2-oxoethyl)-ethylamino]pentanoate
CID 103102891
butyl carbamate;hydrochloride
CID 88609650
butyl carbamate;phosphane
CID 174948771
butyl carbamate;hydroiodide
CID 161347358
2-[2-(2-propoxyethoxy)ethoxy]ethyl carbamate
CID 177163981
ethane;pentyl carbamate
CID 142339635
octacosyl carbamate
CID 160925840
ethyl 2-[bis(2-methoxyethyl)amino]pentanoate
CID 10912289
2-[ethyl(propan-2-yl)amino]acetamide
CID 22371770

Frequently Asked Questions

What is the IUPAC name of 3-(diethylamino)hexyl carbamate?
The IUPAC name of 3-(diethylamino)hexyl carbamate (CID 88732778) is 3-(diethylamino)hexyl carbamate.
What is the SMILES notation for 3-(diethylamino)hexyl carbamate?
The canonical SMILES for 3-(diethylamino)hexyl carbamate is CCCC(CCOC(N)=O)N(CC)CC.
What is the InChIKey of 3-(diethylamino)hexyl carbamate?
The InChIKey is RLKKQYJBKVOPES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-4-7-10(13(5-2)6-3)8-9-15-11(12)14/h10H,4-9H2,1-3H3,(H2,12,14).
What are the key properties of 3-(diethylamino)hexyl carbamate?
3-(diethylamino)hexyl carbamate has a molecular weight of 216.32 g/mol, XLogP of 1.98, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylamino)hexyl carbamate is sourced from PubChem (CID 88732778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).