methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate

C10H20N2O2 — CID 115611657

IUPACmethyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate
SMILESCOC(=O)N(C)CC1CCN(C)CC1
InChIInChI=1S/C10H20N2O2/c1-11-6-4-9(5-7-11)8-12(2)10(13)14-3/h9H,4-8H2,1-3H3
InChIKeyKVBSGZKBTRZISN-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.03
Rot. Bonds2

About methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate

methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate (PubChem CID 115611657) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate.

Molecular Properties

Compound Namemethyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate
PubChem CID115611657
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Namemethyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate
SMILESCOC(=O)N(C)CC1CCN(C)CC1
InChIInChI=1S/C10H20N2O2/c1-11-6-4-9(5-7-11)8-12(2)10(13)14-3/h9H,4-8H2,1-3H3
InChIKeyKVBSGZKBTRZISN-UHFFFAOYSA-N
XLogP1.03
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 ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate?
The IUPAC name of methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate (CID 115611657) is methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate.
What is the SMILES notation for methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate?
The canonical SMILES for methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate is COC(=O)N(C)CC1CCN(C)CC1.
What is the InChIKey of methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate?
The InChIKey is KVBSGZKBTRZISN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-11-6-4-9(5-7-11)8-12(2)10(13)14-3/h9H,4-8H2,1-3H3.
What are the key properties of methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate?
methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate has a molecular weight of 200.28 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-methyl-N-[(1-methylpiperidin-4-yl)methyl]carbamate is sourced from PubChem (CID 115611657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).