(Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine

C14H21N — CID 167306993

IUPAC(Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine
SMILESC/C=C(/CCN(C)C)c1ccccc1C
InChIInChI=1S/C14H21N/c1-5-13(10-11-15(3)4)14-9-7-6-8-12(14)2/h5-9H,10-11H2,1-4H3/b13-5-
InChIKeyHQUQTVJCKVGQMA-ACAGNQJTSA-N
MW203.33 g/mol
LogP3.35
Rot. Bonds4

About (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine

(Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine (PubChem CID 167306993) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine.

Molecular Properties

Compound Name(Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine
PubChem CID167306993
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name(Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine
SMILESC/C=C(/CCN(C)C)c1ccccc1C
InChIInChI=1S/C14H21N/c1-5-13(10-11-15(3)4)14-9-7-6-8-12(14)2/h5-9H,10-11H2,1-4H3/b13-5-
InChIKeyHQUQTVJCKVGQMA-ACAGNQJTSA-N
XLogP3.35
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N'-dimethyl-N'-[(Z)-3-(2-methylphenyl)pent-3-enyl]ethane-1,2-diamine
CID 169001085
3-(dimethylamino)-N-(2-methylphenyl)propanamide
CID 89469008
2-amino-2-methyl-N-[(Z)-3-(2-methylphenyl)pent-3-enyl]propanamide
CID 71216786
(Z)-N,N,2-trimethyl-3-(2-methylphenyl)pent-3-en-1-amine;hydrochloride
CID 140979903
1-methyl-2-oct-4-en-4-ylbenzene
CID 86019229
(Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide
CID 142370556
1-[(E)-but-2-en-2-yl]-2-methylbenzene
CID 12835573
2-(dimethylamino)-1-(2-methylphenyl)ethanone;hydrochloride
CID 178200159
(E)-1-(2-methylphenyl)prop-1-ene-1-thiol
CID 142259115
(Z)-1-(2-methylphenyl)prop-1-en-1-amine
CID 126678655
2-hex-2-en-3-ylphenol
CID 57154775
CID 88514850
CID 88514850

Frequently Asked Questions

What is the IUPAC name of (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine?
The IUPAC name of (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine (CID 167306993) is (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine.
What is the SMILES notation for (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine?
The canonical SMILES for (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine is C/C=C(/CCN(C)C)c1ccccc1C.
What is the InChIKey of (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine?
The InChIKey is HQUQTVJCKVGQMA-ACAGNQJTSA-N. The full InChI is InChI=1S/C14H21N/c1-5-13(10-11-15(3)4)14-9-7-6-8-12(14)2/h5-9H,10-11H2,1-4H3/b13-5-.
What are the key properties of (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine?
(Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.35, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine is sourced from PubChem (CID 167306993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).