[(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin

C20H39NOSn — CID 141455612

IUPAC[(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin
SMILESC/C=C(/CCNC(C)=O)[Sn]C(CCCC)(CCCC)CCCC
InChIInChI=1S/C13H27.C7H12NO.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-3-4-5-6-8-7(2)9;/h4-12H2,1-3H3;3H,5-6H2,1-2H3,(H,8,9);
InChIKeyUMWXRFMETFTPFU-UHFFFAOYSA-N
MW428.25 g/mol
LogP5.85
Rot. Bonds14

About [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin

[(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin (PubChem CID 141455612) has the molecular formula C20H39NOSn and a molecular weight of 428.25 g/mol. Its IUPAC name is [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin.

Molecular Properties

Compound Name[(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin
PubChem CID141455612
Molecular FormulaC20H39NOSn
Molecular Weight428.25 g/mol
Exact Mass429.21
IUPAC Name[(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin
SMILESC/C=C(/CCNC(C)=O)[Sn]C(CCCC)(CCCC)CCCC
InChIInChI=1S/C13H27.C7H12NO.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-3-4-5-6-8-7(2)9;/h4-12H2,1-3H3;3H,5-6H2,1-2H3,(H,8,9);
InChIKeyUMWXRFMETFTPFU-UHFFFAOYSA-N
XLogP5.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.25
LogP ≤ 55.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(Z)-3-tributylstannylpent-3-enyl]acetamide
CID 140736153
5-acetamido-N-butylpentanamide
CID 123729472
N-nonadecylacetamide
CID 54574805
N-butylacetamide;molecular hydrogen
CID 142252069
N-hexylacetamide
CID 24129
N-pentadecylacetamide
CID 12009452
4-acetamido-N-[4-oxo-4-[[4-oxo-4-[[4-oxo-4-(propylamino)butyl]amino]butyl]amino]butyl]butanamide
CID 71430120
N-(2-acetamidoethyl)-2-butyl-2-methyloctanamide
CID 166929446
3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide
CID 103713019
N-butylacetamide;propanoic acid
CID 87146552
N-(4-oxotetradecyl)acetamide
CID 164678896
N-(3-acetamidopropyl)acetamide
CID 5147555

Frequently Asked Questions

What is the IUPAC name of [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin?
The IUPAC name of [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin (CID 141455612) is [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin.
What is the SMILES notation for [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin?
The canonical SMILES for [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin is C/C=C(/CCNC(C)=O)[Sn]C(CCCC)(CCCC)CCCC.
What is the InChIKey of [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin?
The InChIKey is UMWXRFMETFTPFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27.C7H12NO.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-3-4-5-6-8-7(2)9;/h4-12H2,1-3H3;3H,5-6H2,1-2H3,(H,8,9);.
What are the key properties of [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin?
[(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin has a molecular weight of 428.25 g/mol, XLogP of 5.85, 14 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-5-acetamidopent-2-en-3-yl]-(5-butylnonan-5-yl)tin is sourced from PubChem (CID 141455612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).