ethyl N-[(1-aminocyclohexyl)methyl]carbamate

C10H20N2O2 — CID 61300036

IUPACethyl N-[(1-aminocyclohexyl)methyl]carbamate
SMILESCCOC(=O)NCC1(N)CCCCC1
InChIInChI=1S/C10H20N2O2/c1-2-14-9(13)12-8-10(11)6-4-3-5-7-10/h2-8,11H2,1H3,(H,12,13)
InChIKeyKMAWSOLPYSDSLW-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.39
Rot. Bonds3

About ethyl N-[(1-aminocyclohexyl)methyl]carbamate

ethyl N-[(1-aminocyclohexyl)methyl]carbamate (PubChem CID 61300036) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is ethyl N-[(1-aminocyclohexyl)methyl]carbamate.

Molecular Properties

Compound Nameethyl N-[(1-aminocyclohexyl)methyl]carbamate
PubChem CID61300036
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Nameethyl N-[(1-aminocyclohexyl)methyl]carbamate
SMILESCCOC(=O)NCC1(N)CCCCC1
InChIInChI=1S/C10H20N2O2/c1-2-14-9(13)12-8-10(11)6-4-3-5-7-10/h2-8,11H2,1H3,(H,12,13)
InChIKeyKMAWSOLPYSDSLW-UHFFFAOYSA-N
XLogP1.39
TPSA64.35 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 ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl N-[(1-aminocyclohexyl)methyl]carbamate?
The IUPAC name of ethyl N-[(1-aminocyclohexyl)methyl]carbamate (CID 61300036) is ethyl N-[(1-aminocyclohexyl)methyl]carbamate.
What is the SMILES notation for ethyl N-[(1-aminocyclohexyl)methyl]carbamate?
The canonical SMILES for ethyl N-[(1-aminocyclohexyl)methyl]carbamate is CCOC(=O)NCC1(N)CCCCC1.
What is the InChIKey of ethyl N-[(1-aminocyclohexyl)methyl]carbamate?
The InChIKey is KMAWSOLPYSDSLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-2-14-9(13)12-8-10(11)6-4-3-5-7-10/h2-8,11H2,1H3,(H,12,13).
What are the key properties of ethyl N-[(1-aminocyclohexyl)methyl]carbamate?
ethyl N-[(1-aminocyclohexyl)methyl]carbamate has a molecular weight of 200.28 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[(1-aminocyclohexyl)methyl]carbamate is sourced from PubChem (CID 61300036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).