N-benzyl-N-[(Z)-prop-1-enyl]acetamide

C12H15NO — CID 68566363

IUPACN-benzyl-N-[(Z)-prop-1-enyl]acetamide
SMILESC/C=C\N(Cc1ccccc1)C(C)=O
InChIInChI=1S/C12H15NO/c1-3-9-13(11(2)14)10-12-7-5-4-6-8-12/h3-9H,10H2,1-2H3/b9-3-
InChIKeyCVUTWKVGETWPRT-OQFOIZHKSA-N
MW189.26 g/mol
LogP2.57
Rot. Bonds3

About N-benzyl-N-[(Z)-prop-1-enyl]acetamide

N-benzyl-N-[(Z)-prop-1-enyl]acetamide (PubChem CID 68566363) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is N-benzyl-N-[(Z)-prop-1-enyl]acetamide.

Molecular Properties

Compound NameN-benzyl-N-[(Z)-prop-1-enyl]acetamide
PubChem CID68566363
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC NameN-benzyl-N-[(Z)-prop-1-enyl]acetamide
SMILESC/C=C\N(Cc1ccccc1)C(C)=O
InChIInChI=1S/C12H15NO/c1-3-9-13(11(2)14)10-12-7-5-4-6-8-12/h3-9H,10H2,1-2H3/b9-3-
InChIKeyCVUTWKVGETWPRT-OQFOIZHKSA-N
XLogP2.57
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzyl-N-[(E)-but-1-enyl]acetamide
CID 13494620
N,N-dibenzylbut-2-enamide
CID 71340814
N-[2-[acetyl(benzyl)amino]ethyl]-N-benzylacetamide
CID 562449
N'-acetyl-N'-benzylacetohydrazide
CID 23198251
methyl 2-[benzyl(prop-1-enyl)amino]acetate
CID 141322891
(Z)-5-[benzyl(methyl)amino]-2-methylhex-4-en-3-one
CID 176921550
benzyl(ethenyl)carbamic acid
CID 22377754
N-benzyl-N-propan-2-ylacetamide
CID 23534449
2-[benzyl-[(E)-prop-1-enyl]amino]phenol
CID 141322708
carbonic acid;N,N-dimethyl-1-phenylmethanamine
CID 69138278
(E)-4-[benzyl(prop-2-enyl)amino]but-3-en-2-one
CID 135043163
N,N-dibenzyl-2-methylbut-2-en-1-amine
CID 78088479

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[(Z)-prop-1-enyl]acetamide?
The IUPAC name of N-benzyl-N-[(Z)-prop-1-enyl]acetamide (CID 68566363) is N-benzyl-N-[(Z)-prop-1-enyl]acetamide.
What is the SMILES notation for N-benzyl-N-[(Z)-prop-1-enyl]acetamide?
The canonical SMILES for N-benzyl-N-[(Z)-prop-1-enyl]acetamide is C/C=C\N(Cc1ccccc1)C(C)=O.
What is the InChIKey of N-benzyl-N-[(Z)-prop-1-enyl]acetamide?
The InChIKey is CVUTWKVGETWPRT-OQFOIZHKSA-N. The full InChI is InChI=1S/C12H15NO/c1-3-9-13(11(2)14)10-12-7-5-4-6-8-12/h3-9H,10H2,1-2H3/b9-3-.
What are the key properties of N-benzyl-N-[(Z)-prop-1-enyl]acetamide?
N-benzyl-N-[(Z)-prop-1-enyl]acetamide has a molecular weight of 189.26 g/mol, XLogP of 2.57, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[(Z)-prop-1-enyl]acetamide is sourced from PubChem (CID 68566363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).