1-(dimethylamino)propan-2-yl carbamate

C6H14N2O2 — CID 55280985

IUPAC1-(dimethylamino)propan-2-yl carbamate
SMILESCC(CN(C)C)OC(N)=O
InChIInChI=1S/C6H14N2O2/c1-5(4-8(2)3)10-6(7)9/h5H,4H2,1-3H3,(H2,7,9)
InChIKeyISSXNPKZCXRSNU-UHFFFAOYSA-N
MW146.19 g/mol
LogP0.03
Rot. Bonds3

About 1-(dimethylamino)propan-2-yl carbamate

1-(dimethylamino)propan-2-yl carbamate (PubChem CID 55280985) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 1-(dimethylamino)propan-2-yl carbamate.

Molecular Properties

Compound Name1-(dimethylamino)propan-2-yl carbamate
PubChem CID55280985
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name1-(dimethylamino)propan-2-yl carbamate
SMILESCC(CN(C)C)OC(N)=O
InChIInChI=1S/C6H14N2O2/c1-5(4-8(2)3)10-6(7)9/h5H,4H2,1-3H3,(H2,7,9)
InChIKeyISSXNPKZCXRSNU-UHFFFAOYSA-N
XLogP0.03
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)propan-2-yl carbamate?
The IUPAC name of 1-(dimethylamino)propan-2-yl carbamate (CID 55280985) is 1-(dimethylamino)propan-2-yl carbamate.
What is the SMILES notation for 1-(dimethylamino)propan-2-yl carbamate?
The canonical SMILES for 1-(dimethylamino)propan-2-yl carbamate is CC(CN(C)C)OC(N)=O.
What is the InChIKey of 1-(dimethylamino)propan-2-yl carbamate?
The InChIKey is ISSXNPKZCXRSNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-5(4-8(2)3)10-6(7)9/h5H,4H2,1-3H3,(H2,7,9).
What are the key properties of 1-(dimethylamino)propan-2-yl carbamate?
1-(dimethylamino)propan-2-yl carbamate has a molecular weight of 146.19 g/mol, XLogP of 0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)propan-2-yl carbamate is sourced from PubChem (CID 55280985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).