(Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine

C9H13NS — CID 5452261

IUPAC(Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine
SMILESCN(C)C/C=C\c1cccs1
InChIInChI=1S/C9H13NS/c1-10(2)7-3-5-9-6-4-8-11-9/h3-6,8H,7H2,1-2H3/b5-3-
InChIKeyOFSSDKDJIKXVSO-HYXAFXHYSA-N
MW167.28 g/mol
LogP2.32
Rot. Bonds3

About (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine

(Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine (PubChem CID 5452261) has the molecular formula C9H13NS and a molecular weight of 167.28 g/mol. Its IUPAC name is (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine.

Molecular Properties

Compound Name(Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine
PubChem CID5452261
Molecular FormulaC9H13NS
Molecular Weight167.28 g/mol
Exact Mass167.08
IUPAC Name(Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine
SMILESCN(C)C/C=C\c1cccs1
InChIInChI=1S/C9H13NS/c1-10(2)7-3-5-9-6-4-8-11-9/h3-6,8H,7H2,1-2H3/b5-3-
InChIKeyOFSSDKDJIKXVSO-HYXAFXHYSA-N
XLogP2.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.28
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2E,5E)-N,N-dimethyl-6-thiophen-2-ylhexa-2,5-dien-1-amine
CID 20603575
2-[(1Z,4Z)-hepta-1,4-dienyl]thiophene
CID 156698517
N,N-dimethyl-1-phenyl-4-thiophen-2-ylbut-3-en-1-amine
CID 139632410
2-(4-chlorobut-1-enyl)thiophene
CID 79002392
4-thiophen-2-ylbut-3-enenitrile
CID 170799049
(E)-2-thiophen-2-ylethenol
CID 89297537
(dimethylamino)methyl (Z)-3-thiophen-2-ylprop-2-enoate
CID 122223996
S-[(E)-3-thiophen-2-ylprop-2-enyl] ethanethioate
CID 71663485
[(E)-3-thiophen-2-ylprop-2-enyl] acetate
CID 11298325
2-(dimethylamino)-2-phenyl-5-thiophen-2-ylpent-4-enenitrile
CID 54433898
(E)-N,N-dimethyl-3-thiophen-3-ylprop-2-en-1-amine
CID 20603574
5-thiophen-2-ylpenta-2,4-dien-1-ol
CID 54372046

Frequently Asked Questions

What is the IUPAC name of (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine?
The IUPAC name of (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine (CID 5452261) is (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine.
What is the SMILES notation for (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine?
The canonical SMILES for (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine is CN(C)C/C=C\c1cccs1.
What is the InChIKey of (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine?
The InChIKey is OFSSDKDJIKXVSO-HYXAFXHYSA-N. The full InChI is InChI=1S/C9H13NS/c1-10(2)7-3-5-9-6-4-8-11-9/h3-6,8H,7H2,1-2H3/b5-3-.
What are the key properties of (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine?
(Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine has a molecular weight of 167.28 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N-dimethyl-3-thiophen-2-ylprop-2-en-1-amine is sourced from PubChem (CID 5452261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).