N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide

C7H17N3O — CID 20578864

IUPACN-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide
SMILESCNCC(CNC)C(=O)NC
InChIInChI=1S/C7H17N3O/c1-8-4-6(5-9-2)7(11)10-3/h6,8-9H,4-5H2,1-3H3,(H,10,11)
InChIKeyDXKRXIDZBWYFQY-UHFFFAOYSA-N
MW159.23 g/mol
LogP-1.21
Rot. Bonds5

About N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide

N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide (PubChem CID 20578864) has the molecular formula C7H17N3O and a molecular weight of 159.23 g/mol. Its IUPAC name is N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide.

Molecular Properties

Compound NameN-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide
PubChem CID20578864
Molecular FormulaC7H17N3O
Molecular Weight159.23 g/mol
Exact Mass159.14
IUPAC NameN-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide
SMILESCNCC(CNC)C(=O)NC
InChIInChI=1S/C7H17N3O/c1-8-4-6(5-9-2)7(11)10-3/h6,8-9H,4-5H2,1-3H3,(H,10,11)
InChIKeyDXKRXIDZBWYFQY-UHFFFAOYSA-N
XLogP-1.21
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 5-1.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-Methylisobutyramide
CID 221961
3-Amino-N-methylpropanamide
CID 14889074
N-methyl-3-(methylamino)propanamide
CID 12548977
N-ethylazetidine-3-carboxamide
CID 65963358
N~3~-Methyl-beta-alaninamide
CID 22182162
N,2-dimethyl-3-(methylamino)propanamide
CID 20578861
3-amino-N-methylpropanamide hydrochloride
CID 14889075
2-methyl-N-[2-(methylamino)ethyl]propanamide
CID 22754909
N-methylazetidine-3-carboxamide
CID 59597796
3-amino-N-ethyl-2,2-dimethylpropanamide
CID 61826263
3-[3-(Dimethylamino)propylamino]propanamide
CID 3097430
3-amino-N,N-diethylpropanamide
CID 16793555

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide?
The IUPAC name of N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide (CID 20578864) is N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide.
What is the SMILES notation for N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide?
The canonical SMILES for N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide is CNCC(CNC)C(=O)NC.
What is the InChIKey of N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide?
The InChIKey is DXKRXIDZBWYFQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O/c1-8-4-6(5-9-2)7(11)10-3/h6,8-9H,4-5H2,1-3H3,(H,10,11).
What are the key properties of N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide?
N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide has a molecular weight of 159.23 g/mol, XLogP of -1.21, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(methylamino)-2-(methylaminomethyl)propanamide is sourced from PubChem (CID 20578864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).