2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate

C10H19NO2 — CID 162502181

IUPAC2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate
SMILESC=C(C)CN(C)C(=O)OCC(C)C
InChIInChI=1S/C10H19NO2/c1-8(2)6-11(5)10(12)13-7-9(3)4/h9H,1,6-7H2,2-5H3
InChIKeyANJBVLYESVDRCP-UHFFFAOYSA-N
MW185.27 g/mol
LogP2.29
Rot. Bonds4

About 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate

2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate (PubChem CID 162502181) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate.

Molecular Properties

Compound Name2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate
PubChem CID162502181
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate
SMILESC=C(C)CN(C)C(=O)OCC(C)C
InChIInChI=1S/C10H19NO2/c1-8(2)6-11(5)10(12)13-7-9(3)4/h9H,1,6-7H2,2-5H3
InChIKeyANJBVLYESVDRCP-UHFFFAOYSA-N
XLogP2.29
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[methyl(2-methylpropoxycarbonyl)amino]ethyl acetate
CID 165163871
2-methylpropyl N-(2-chloroethyl)-N-methylcarbamate
CID 106441648
5-methylhexa-3,4-dien-3-yl 2-[methyl(2-methylpropoxycarbonyl)amino]acetate
CID 88928519
(2R)-2-amino-N-methyl-N-(2-methylprop-2-enyl)propanamide
CID 104868591
2-methylpropyl N-(2-methoxyethyl)-N-methylcarbamate
CID 167089831
1-methyl-1-(2-methylprop-2-enyl)urea
CID 115964716
N-methyl-N-(2-methylprop-2-enyl)acetamide
CID 115968492
2-methylpropyl N,N-bis(2-hydroxyethyl)carbamate
CID 61233456
2-[2-methylpropoxycarbonyl(prop-2-enyl)amino]acetic acid
CID 79263335
1-ethyl-1-methyl-3-(2-methylpropoxy)urea
CID 115752940
2-methylpropyl 2,5-dimethylhex-5-enoate
CID 162502138
2-methylpropyl acetate;hydrate
CID 86585368

Frequently Asked Questions

What is the IUPAC name of 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate?
The IUPAC name of 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate (CID 162502181) is 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate.
What is the SMILES notation for 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate?
The canonical SMILES for 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate is C=C(C)CN(C)C(=O)OCC(C)C.
What is the InChIKey of 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate?
The InChIKey is ANJBVLYESVDRCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-8(2)6-11(5)10(12)13-7-9(3)4/h9H,1,6-7H2,2-5H3.
What are the key properties of 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate?
2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate has a molecular weight of 185.27 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropyl N-methyl-N-(2-methylprop-2-enyl)carbamate is sourced from PubChem (CID 162502181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).