N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine

C14H20N2 — CID 72560382

IUPACN,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine
SMILESC/N=C(\C=C(C)N(C)C)Cc1ccccc1
InChIInChI=1S/C14H20N2/c1-12(16(3)4)10-14(15-2)11-13-8-6-5-7-9-13/h5-10H,11H2,1-4H3/b12-10?,15-14+
InChIKeyJSYORAPFLWXEAE-PMBRTEEHSA-N
MW216.33 g/mol
LogP2.77
Rot. Bonds4

About N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine

N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine (PubChem CID 72560382) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine
PubChem CID72560382
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC NameN,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine
SMILESC/N=C(\C=C(C)N(C)C)Cc1ccccc1
InChIInChI=1S/C14H20N2/c1-12(16(3)4)10-14(15-2)11-13-8-6-5-7-9-13/h5-10H,11H2,1-4H3/b12-10?,15-14+
InChIKeyJSYORAPFLWXEAE-PMBRTEEHSA-N
XLogP2.77
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

benzyl (Z)-3-(dimethylamino)but-2-enoate
CID 139616986
1-phenylpropane-2-thione
CID 19915653
N,N-dimethyl-N',2-diphenylethanimidamide
CID 525868
(E)-3-(dimethylamino)-1-phenylbut-2-en-1-one
CID 11019632
[(Z)-2-methylbut-2-enyl]benzene
CID 59870366
(E)-N,N-dimethyl-1-phenylprop-1-en-2-amine
CID 12573346
3-methyl-4-phenylbut-2-enoic acid
CID 22414
(E)-3-methyl-4-phenylbut-2-enoic acid
CID 6369541
N'-benzyl-N,N-dimethylethanimidamide
CID 525276
(Z)-5-[benzyl(methyl)amino]-2-methylhex-4-en-3-one
CID 176921550
(E)-1-phenylbut-2-en-2-ol
CID 170790149
benzene;1-phenylpropan-2-one
CID 21430852

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine?
The IUPAC name of N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine (CID 72560382) is N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine.
What is the SMILES notation for N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine?
The canonical SMILES for N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine is C/N=C(\C=C(C)N(C)C)Cc1ccccc1.
What is the InChIKey of N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine?
The InChIKey is JSYORAPFLWXEAE-PMBRTEEHSA-N. The full InChI is InChI=1S/C14H20N2/c1-12(16(3)4)10-14(15-2)11-13-8-6-5-7-9-13/h5-10H,11H2,1-4H3/b12-10?,15-14+.
What are the key properties of N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine?
N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine has a molecular weight of 216.33 g/mol, XLogP of 2.77, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-methylimino-5-phenylpent-2-en-2-amine is sourced from PubChem (CID 72560382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).