methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide

C8H21N3O — CID 160845776

IUPACmethane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide
SMILESC.CNCCN(C)C(=O)CNC
InChIInChI=1S/C7H17N3O.CH4/c1-8-4-5-10(3)7(11)6-9-2;/h8-9H,4-6H2,1-3H3;1H4
InChIKeySIPVZWCTHYXCSD-UHFFFAOYSA-N
MW175.28 g/mol
LogP-0.48
Rot. Bonds5

About methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide

methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide (PubChem CID 160845776) has the molecular formula C8H21N3O and a molecular weight of 175.28 g/mol. Its IUPAC name is methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide.

Molecular Properties

Compound Namemethane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide
PubChem CID160845776
Molecular FormulaC8H21N3O
Molecular Weight175.28 g/mol
Exact Mass175.17
IUPAC Namemethane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide
SMILESC.CNCCN(C)C(=O)CNC
InChIInChI=1S/C7H17N3O.CH4/c1-8-4-5-10(3)7(11)6-9-2;/h8-9H,4-6H2,1-3H3;1H4
InChIKeySIPVZWCTHYXCSD-UHFFFAOYSA-N
XLogP-0.48
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.28
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-N-methyl-N-[2-(methylamino)ethyl]acetamide
CID 87509746
N-(3,3-dimethylbutyl)-N-methyl-2-(methylamino)acetamide
CID 115152053
N-[8-(dimethylamino)octyl]-N-methyl-2-(methylamino)acetamide
CID 54022406
N-ethyl-N-methyl-2-(methylamino)acetamide
CID 18683928
N-hydroxy-N-methyl-2-(methylamino)acetamide
CID 131096928
methyl-[2-(methylamino)ethyl]carbamothioic S-acid
CID 55299053
N-methyl-N-[2-(methylamino)ethyl]decanamide
CID 65449488
N-methyl-2-(methylamino)-N-(2-propan-2-yloxyethyl)acetamide
CID 81056033
methyl 4-[methyl-[2-(methylamino)acetyl]amino]butanoate
CID 60947887
methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane
CID 161126143
N-methyl-N-[2-(methylamino)ethyl]-2-phenylacetamide
CID 23084464
N,N-dimethyl-2-(methylamino)acetamide;sulfuric acid
CID 87663506

Frequently Asked Questions

What is the IUPAC name of methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide?
The IUPAC name of methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide (CID 160845776) is methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide.
What is the SMILES notation for methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide?
The canonical SMILES for methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide is C.CNCCN(C)C(=O)CNC.
What is the InChIKey of methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide?
The InChIKey is SIPVZWCTHYXCSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O.CH4/c1-8-4-5-10(3)7(11)6-9-2;/h8-9H,4-6H2,1-3H3;1H4.
What are the key properties of methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide?
methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide has a molecular weight of 175.28 g/mol, XLogP of -0.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide is sourced from PubChem (CID 160845776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).