(1-ethylpiperidin-3-yl) N,N-dimethylcarbamate

C10H20N2O2 — CID 45091641

IUPAC(1-ethylpiperidin-3-yl) N,N-dimethylcarbamate
SMILESCCN1CCCC(OC(=O)N(C)C)C1
InChIInChI=1S/C10H20N2O2/c1-4-12-7-5-6-9(8-12)14-10(13)11(2)3/h9H,4-8H2,1-3H3
InChIKeyHPSHNHYGHKHLRE-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.17
Rot. Bonds2

About (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate

(1-ethylpiperidin-3-yl) N,N-dimethylcarbamate (PubChem CID 45091641) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate.

Molecular Properties

Compound Name(1-ethylpiperidin-3-yl) N,N-dimethylcarbamate
PubChem CID45091641
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name(1-ethylpiperidin-3-yl) N,N-dimethylcarbamate
SMILESCCN1CCCC(OC(=O)N(C)C)C1
InChIInChI=1S/C10H20N2O2/c1-4-12-7-5-6-9(8-12)14-10(13)11(2)3/h9H,4-8H2,1-3H3
InChIKeyHPSHNHYGHKHLRE-UHFFFAOYSA-N
XLogP1.17
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-Piperidinecarboxylic acid, diethylaminoethyl ester
CID 410183
1-Piperidinecarboxylic acid, isopropyl ester
CID 239243
Ammonium, (2-hydroxyethyl)trimethyl-, iodide, 1-piperidinecarboxylate
CID 46590
2-Oxazolidinone, 5-(1-piperidinylmethyl)-3-propyl-, monohydrobromide
CID 3040557
Piperidinium, 1,1-dimethyl-3-hydroxy-, bromide, dimethylcarbamate (ester)
CID 3051243
Tert-butyl 3-(aminooxy)piperidine-1-carboxylate
CID 68983062
Tert-butyl 2-(3-aminopropyl)morpholine-4-carboxylate
CID 82385593
(1-prop-2-ynylpiperidin-3-yl) N-ethyl-N-methylcarbamate
CID 162668773
Ethyl 3,4,4-trimethoxypiperidine-1-carboxylate
CID 3019431
Propan-2-yl 3-hydroxypiperidine-1-carboxylate
CID 61798544
piperidin-3-yl N,N-dimethylcarbamate hydrochloride
CID 121552397
1,1-Dimethyl-3-acetoxypiperidine
CID 191381

Frequently Asked Questions

What is the IUPAC name of (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate?
The IUPAC name of (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate (CID 45091641) is (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate.
What is the SMILES notation for (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate?
The canonical SMILES for (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate is CCN1CCCC(OC(=O)N(C)C)C1.
What is the InChIKey of (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate?
The InChIKey is HPSHNHYGHKHLRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-4-12-7-5-6-9(8-12)14-10(13)11(2)3/h9H,4-8H2,1-3H3.
What are the key properties of (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate?
(1-ethylpiperidin-3-yl) N,N-dimethylcarbamate has a molecular weight of 200.28 g/mol, XLogP of 1.17, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylpiperidin-3-yl) N,N-dimethylcarbamate is sourced from PubChem (CID 45091641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).