amino N,N-bis(prop-2-enyl)carbamate

C7H12N2O2 — CID 88511784

IUPACamino N,N-bis(prop-2-enyl)carbamate
SMILESC=CCN(CC=C)C(=O)ON
InChIInChI=1S/C7H12N2O2/c1-3-5-9(6-4-2)7(10)11-8/h3-4H,1-2,5-6,8H2
InChIKeyLRDYYJXOWASZQR-UHFFFAOYSA-N
MW156.18 g/mol
LogP0.67
Rot. Bonds4

About amino N,N-bis(prop-2-enyl)carbamate

amino N,N-bis(prop-2-enyl)carbamate (PubChem CID 88511784) has the molecular formula C7H12N2O2 and a molecular weight of 156.18 g/mol. Its IUPAC name is amino N,N-bis(prop-2-enyl)carbamate.

Molecular Properties

Compound Nameamino N,N-bis(prop-2-enyl)carbamate
PubChem CID88511784
Molecular FormulaC7H12N2O2
Molecular Weight156.18 g/mol
Exact Mass156.09
IUPAC Nameamino N,N-bis(prop-2-enyl)carbamate
SMILESC=CCN(CC=C)C(=O)ON
InChIInChI=1S/C7H12N2O2/c1-3-5-9(6-4-2)7(10)11-8/h3-4H,1-2,5-6,8H2
InChIKeyLRDYYJXOWASZQR-UHFFFAOYSA-N
XLogP0.67
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

pentyl N,N-bis(prop-2-enyl)carbamate
CID 88848482
prop-2-enyl 2-[bis(prop-2-enyl)amino]-2-oxoacetate
CID 139567559
N,N-bis(prop-2-enyl)carbamoyl fluoride
CID 21354913
bis(prop-2-enyl)carbamothioic S-acid;carbamothioic S-acid
CID 87059651
2-hydroxy-N,N-bis(prop-2-enyl)acetamide
CID 13241436
ethyl 2-[bis(prop-2-enyl)amino]prop-2-enoate
CID 87228347
ethyl N-(3-oxopropyl)-N-prop-2-enylcarbamate
CID 163829772
2,2,2-trifluoroethyl N-ethyl-N-prop-2-enylcarbamate
CID 78983348
2-fluoro-N,N-bis(prop-2-enyl)acetamide
CID 176847586
2,2,2-trichloro-N,N-bis(prop-2-enyl)acetamide
CID 736559
2-[2-methylpropoxycarbonyl(prop-2-enyl)amino]acetic acid
CID 79263335
1-amino-N,N-bis(prop-2-enyl)cyclopropane-1-carboxamide
CID 65464830

Frequently Asked Questions

What is the IUPAC name of amino N,N-bis(prop-2-enyl)carbamate?
The IUPAC name of amino N,N-bis(prop-2-enyl)carbamate (CID 88511784) is amino N,N-bis(prop-2-enyl)carbamate.
What is the SMILES notation for amino N,N-bis(prop-2-enyl)carbamate?
The canonical SMILES for amino N,N-bis(prop-2-enyl)carbamate is C=CCN(CC=C)C(=O)ON.
What is the InChIKey of amino N,N-bis(prop-2-enyl)carbamate?
The InChIKey is LRDYYJXOWASZQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-3-5-9(6-4-2)7(10)11-8/h3-4H,1-2,5-6,8H2.
What are the key properties of amino N,N-bis(prop-2-enyl)carbamate?
amino N,N-bis(prop-2-enyl)carbamate has a molecular weight of 156.18 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for amino N,N-bis(prop-2-enyl)carbamate is sourced from PubChem (CID 88511784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).