N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine

C14H19N — CID 103092958

IUPACN,3-dimethyl-6-phenylhexa-3,5-dien-2-amine
SMILESCNC(C)C(C)=CC=Cc1ccccc1
InChIInChI=1S/C14H19N/c1-12(13(2)15-3)8-7-11-14-9-5-4-6-10-14/h4-11,13,15H,1-3H3
InChIKeyQQTLCYUJYCFHAQ-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.25
Rot. Bonds4

About N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine

N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine (PubChem CID 103092958) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine.

Molecular Properties

Compound NameN,3-dimethyl-6-phenylhexa-3,5-dien-2-amine
PubChem CID103092958
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC NameN,3-dimethyl-6-phenylhexa-3,5-dien-2-amine
SMILESCNC(C)C(C)=CC=Cc1ccccc1
InChIInChI=1S/C14H19N/c1-12(13(2)15-3)8-7-11-14-9-5-4-6-10-14/h4-11,13,15H,1-3H3
InChIKeyQQTLCYUJYCFHAQ-UHFFFAOYSA-N
XLogP3.25
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

4-methylpenta-1,3-dienylbenzene
CID 3614395
(3-methyl-6-phenylhexa-1,3,5-trienyl)benzene
CID 618811
(5-chloro-4-methylpenta-1,3-dienyl)benzene
CID 79323612
(3Z,5E)-3-methoxy-6-phenylhexa-3,5-dien-2-one
CID 101120530
1-chloro-4-phenylbuta-1,3-dien-1-ol
CID 88848274
2-ethyl-5-phenyl-N-propan-2-ylpenta-2,4-dien-1-amine
CID 79328984
[(1Z,3Z)-4-phenylbuta-1,3-dienyl]benzene
CID 139179602
4-phenylbuta-1,3-dienylbenzene
CID 162273071
trimethyl-(4-phenyl-1-trimethylsilylbuta-1,3-dienyl)silane
CID 71383002
3-phenylprop-2-enal;propan-2-ol
CID 158457423
4-(5-phenylpenta-2,4-dien-2-yl)phenol
CID 87425286
(2Z,4E)-2-ethenyl-5-phenylpenta-2,4-dienenitrile
CID 12034343

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine?
The IUPAC name of N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine (CID 103092958) is N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine.
What is the SMILES notation for N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine?
The canonical SMILES for N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine is CNC(C)C(C)=CC=Cc1ccccc1.
What is the InChIKey of N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine?
The InChIKey is QQTLCYUJYCFHAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-12(13(2)15-3)8-7-11-14-9-5-4-6-10-14/h4-11,13,15H,1-3H3.
What are the key properties of N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine?
N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine has a molecular weight of 201.31 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-6-phenylhexa-3,5-dien-2-amine is sourced from PubChem (CID 103092958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).