methyl N-[2-(cyclopropylamino)ethyl]carbamate

C7H14N2O2 — CID 62663328

IUPACmethyl N-[2-(cyclopropylamino)ethyl]carbamate
SMILESCOC(=O)NCCNC1CC1
InChIInChI=1S/C7H14N2O2/c1-11-7(10)9-5-4-8-6-2-3-6/h6,8H,2-5H2,1H3,(H,9,10)
InChIKeyUFELXYJUFIFABY-UHFFFAOYSA-N
MW158.20 g/mol
LogP0.09
Rot. Bonds4

About methyl N-[2-(cyclopropylamino)ethyl]carbamate

methyl N-[2-(cyclopropylamino)ethyl]carbamate (PubChem CID 62663328) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is methyl N-[2-(cyclopropylamino)ethyl]carbamate.

Molecular Properties

Compound Namemethyl N-[2-(cyclopropylamino)ethyl]carbamate
PubChem CID62663328
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Namemethyl N-[2-(cyclopropylamino)ethyl]carbamate
SMILESCOC(=O)NCCNC1CC1
InChIInChI=1S/C7H14N2O2/c1-11-7(10)9-5-4-8-6-2-3-6/h6,8H,2-5H2,1H3,(H,9,10)
InChIKeyUFELXYJUFIFABY-UHFFFAOYSA-N
XLogP0.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

methyl N-[2-(cycloheptylamino)ethyl]carbamate
CID 115306508
tert-butyl N-[2-[(4-methylcyclohexyl)amino]ethyl]carbamate
CID 103653351
tert-butyl N-[2-(cyclododecylamino)ethyl]carbamate
CID 107241352
tert-butyl N-[2-[(3-methoxycyclopentyl)amino]ethyl]carbamate
CID 103081858
tert-butyl N-[2-(oxan-4-ylamino)ethyl]carbamate
CID 58117128
tert-butyl N-[2-[[4-(2-amino-2-oxoethyl)cyclohexyl]amino]ethyl]carbamate
CID 141409731
N-[2-[(4-methoxycyclohexyl)amino]ethyl]cyclopropanecarboxamide
CID 113422916
methyl 4-[2-(carbamoylamino)ethylamino]cyclohexane-1-carboxylate
CID 112753620
tert-butyl N-[2-(azetidin-3-ylamino)ethyl]carbamate
CID 107241432
tert-butyl N-[2-[[4-tri(propan-2-yl)silyloxycyclohexyl]amino]ethyl]carbamate
CID 123710805
methyl N-[2-[[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]amino]ethyl]carbamate
CID 144745494
tert-butyl N-[4-(cyclobutylamino)butyl]carbamate
CID 130986034

Frequently Asked Questions

What is the IUPAC name of methyl N-[2-(cyclopropylamino)ethyl]carbamate?
The IUPAC name of methyl N-[2-(cyclopropylamino)ethyl]carbamate (CID 62663328) is methyl N-[2-(cyclopropylamino)ethyl]carbamate.
What is the SMILES notation for methyl N-[2-(cyclopropylamino)ethyl]carbamate?
The canonical SMILES for methyl N-[2-(cyclopropylamino)ethyl]carbamate is COC(=O)NCCNC1CC1.
What is the InChIKey of methyl N-[2-(cyclopropylamino)ethyl]carbamate?
The InChIKey is UFELXYJUFIFABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-11-7(10)9-5-4-8-6-2-3-6/h6,8H,2-5H2,1H3,(H,9,10).
What are the key properties of methyl N-[2-(cyclopropylamino)ethyl]carbamate?
methyl N-[2-(cyclopropylamino)ethyl]carbamate has a molecular weight of 158.20 g/mol, XLogP of 0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[2-(cyclopropylamino)ethyl]carbamate is sourced from PubChem (CID 62663328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).