(1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate

C10H18N2O2 — CID 146478948

IUPAC(1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate
SMILESCC1=CC(COC(N)=O)CC(C)N1C
InChIInChI=1S/C10H18N2O2/c1-7-4-9(6-14-10(11)13)5-8(2)12(7)3/h4,8-9H,5-6H2,1-3H3,(H2,11,13)
InChIKeyPWCBNSIBEDSROX-UHFFFAOYSA-N
MW198.27 g/mol
LogP1.33
Rot. Bonds2

About (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate

(1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate (PubChem CID 146478948) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate.

Molecular Properties

Compound Name(1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate
PubChem CID146478948
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name(1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate
SMILESCC1=CC(COC(N)=O)CC(C)N1C
InChIInChI=1S/C10H18N2O2/c1-7-4-9(6-14-10(11)13)5-8(2)12(7)3/h4,8-9H,5-6H2,1-3H3,(H2,11,13)
InChIKeyPWCBNSIBEDSROX-UHFFFAOYSA-N
XLogP1.33
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate?
The IUPAC name of (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate (CID 146478948) is (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate.
What is the SMILES notation for (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate?
The canonical SMILES for (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate is CC1=CC(COC(N)=O)CC(C)N1C.
What is the InChIKey of (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate?
The InChIKey is PWCBNSIBEDSROX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-7-4-9(6-14-10(11)13)5-8(2)12(7)3/h4,8-9H,5-6H2,1-3H3,(H2,11,13).
What are the key properties of (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate?
(1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate has a molecular weight of 198.27 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2,6-trimethyl-3,4-dihydro-2H-pyridin-4-yl)methyl carbamate is sourced from PubChem (CID 146478948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).