N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide

C6H13N3O — CID 135230871

IUPACN-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide
SMILESCN/C=C(\N)CNC(C)=O
InChIInChI=1S/C6H13N3O/c1-5(10)9-4-6(7)3-8-2/h3,8H,4,7H2,1-2H3,(H,9,10)/b6-3-
InChIKeyKCWSJLVIEPEBHZ-UTCJRWHESA-N
MW143.19 g/mol
LogP-0.86
Rot. Bonds3

About N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide

N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide (PubChem CID 135230871) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide.

Molecular Properties

Compound NameN-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide
PubChem CID135230871
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC NameN-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide
SMILESCN/C=C(\N)CNC(C)=O
InChIInChI=1S/C6H13N3O/c1-5(10)9-4-6(7)3-8-2/h3,8H,4,7H2,1-2H3,(H,9,10)/b6-3-
InChIKeyKCWSJLVIEPEBHZ-UTCJRWHESA-N
XLogP-0.86
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide?
The IUPAC name of N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide (CID 135230871) is N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide.
What is the SMILES notation for N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide?
The canonical SMILES for N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide is CN/C=C(\N)CNC(C)=O.
What is the InChIKey of N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide?
The InChIKey is KCWSJLVIEPEBHZ-UTCJRWHESA-N. The full InChI is InChI=1S/C6H13N3O/c1-5(10)9-4-6(7)3-8-2/h3,8H,4,7H2,1-2H3,(H,9,10)/b6-3-.
What are the key properties of N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide?
N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide has a molecular weight of 143.19 g/mol, XLogP of -0.86, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-amino-3-(methylamino)prop-2-enyl]acetamide is sourced from PubChem (CID 135230871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).