ethyl N-[4-(methylamino)cyclohexyl]carbamate

C10H20N2O2 — CID 43653652

IUPACethyl N-[4-(methylamino)cyclohexyl]carbamate
SMILESCCOC(=O)NC1CCC(NC)CC1
InChIInChI=1S/C10H20N2O2/c1-3-14-10(13)12-9-6-4-8(11-2)5-7-9/h8-9,11H,3-7H2,1-2H3,(H,12,13)
InChIKeyFUHBTNACBNJQOA-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.26
Rot. Bonds3

About ethyl N-[4-(methylamino)cyclohexyl]carbamate

ethyl N-[4-(methylamino)cyclohexyl]carbamate (PubChem CID 43653652) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is ethyl N-[4-(methylamino)cyclohexyl]carbamate.

Molecular Properties

Compound Nameethyl N-[4-(methylamino)cyclohexyl]carbamate
PubChem CID43653652
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Nameethyl N-[4-(methylamino)cyclohexyl]carbamate
SMILESCCOC(=O)NC1CCC(NC)CC1
InChIInChI=1S/C10H20N2O2/c1-3-14-10(13)12-9-6-4-8(11-2)5-7-9/h8-9,11H,3-7H2,1-2H3,(H,12,13)
InChIKeyFUHBTNACBNJQOA-UHFFFAOYSA-N
XLogP1.26
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl N-(4-propylcyclohexyl)carbamate
CID 61381222
ethyl N-(thian-4-yl)carbamate
CID 115599837
ethyl N-(4-oxocyclohexyl)carbamate
CID 12546192
ethyl N-(1-methylpiperidin-4-yl)carbamate
CID 58960911
ethyl N-(4-butylcyclohexyl)carbamate
CID 145473547
methyl N-[4-(methylamino)cyclohexyl]carbamate
CID 43653640
ethyl N-(4-hydroxy-4-methylcyclohexyl)carbamate
CID 22273026
ethyl N-(1-cyclopropylpiperidin-4-yl)carbamate
CID 60709264
ethyl N-pyrrolidin-3-ylcarbamate
CID 11321104
[4-(propoxycarbonylamino)cyclohexyl]carbamic acid
CID 139823141
ethyl N-(1,3-dioxan-5-yl)carbamate
CID 67075992
ethyl 4-(methoxycarbonylamino)cyclohexane-1-carboxylate
CID 115270432

Frequently Asked Questions

What is the IUPAC name of ethyl N-[4-(methylamino)cyclohexyl]carbamate?
The IUPAC name of ethyl N-[4-(methylamino)cyclohexyl]carbamate (CID 43653652) is ethyl N-[4-(methylamino)cyclohexyl]carbamate.
What is the SMILES notation for ethyl N-[4-(methylamino)cyclohexyl]carbamate?
The canonical SMILES for ethyl N-[4-(methylamino)cyclohexyl]carbamate is CCOC(=O)NC1CCC(NC)CC1.
What is the InChIKey of ethyl N-[4-(methylamino)cyclohexyl]carbamate?
The InChIKey is FUHBTNACBNJQOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-14-10(13)12-9-6-4-8(11-2)5-7-9/h8-9,11H,3-7H2,1-2H3,(H,12,13).
What are the key properties of ethyl N-[4-(methylamino)cyclohexyl]carbamate?
ethyl N-[4-(methylamino)cyclohexyl]carbamate has a molecular weight of 200.28 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[4-(methylamino)cyclohexyl]carbamate is sourced from PubChem (CID 43653652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).