N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine

C29H29N — CID 143655801

IUPACN-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine
SMILESCNc1ccc2ccccc2c1C(C)(C/C=C/c1ccccc1)Cc1ccccc1
InChIInChI=1S/C29H29N/c1-29(22-24-14-7-4-8-15-24,21-11-16-23-12-5-3-6-13-23)28-26-18-10-9-17-25(26)19-20-27(28)30-2/h3-20,30H,21-22H2,1-2H3/b16-11+
InChIKeyXDLZKNVVFVMGIW-LFIBNONCSA-N
MW391.56 g/mol
LogP7.49
Rot. Bonds7

About N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine

N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine (PubChem CID 143655801) has the molecular formula C29H29N and a molecular weight of 391.56 g/mol. Its IUPAC name is N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine.

Molecular Properties

Compound NameN-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine
PubChem CID143655801
Molecular FormulaC29H29N
Molecular Weight391.56 g/mol
Exact Mass391.23
IUPAC NameN-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine
SMILESCNc1ccc2ccccc2c1C(C)(C/C=C/c1ccccc1)Cc1ccccc1
InChIInChI=1S/C29H29N/c1-29(22-24-14-7-4-8-15-24,21-11-16-23-12-5-3-6-13-23)28-26-18-10-9-17-25(26)19-20-27(28)30-2/h3-20,30H,21-22H2,1-2H3/b16-11+
InChIKeyXDLZKNVVFVMGIW-LFIBNONCSA-N
XLogP7.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.56
LogP ≤ 57.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(4E,6E)-7-anilino-2-methyl-1-(4-phenylphenyl)hepta-4,6-dien-2-yl]-N-methylnaphthalen-2-amine
CID 145488846
1-[(4E,6E)-7-anilino-2-methyl-1-phenylhepta-4,6-dien-2-yl]-N-propylnaphthalen-2-amine
CID 145488822
1-(2-methyl-1-phenylbutan-2-yl)-N-propylnaphthalen-2-amine
CID 145488877
1-[(1E)-4,7-dimethyl-1-thiophen-2-ylocta-1,6-dien-4-yl]-N-methylnaphthalen-2-amine
CID 143792769
N-methyl-1-[(1E)-3-methylidene-1-phenyl-4-prop-2-enylhepta-1,6-dien-4-yl]naphthalen-2-amine
CID 143792896
3-[[1-(2-methyl-1-phenylbutan-2-yl)naphthalen-2-yl]amino]propanal
CID 143968265
2-[4-[2-methyl-2-[2-(methylamino)naphthalen-1-yl]butyl]phenyl]benzonitrile
CID 145488850
N-[(E)-3-phenylprop-2-enyl]naphthalen-1-amine
CID 7949251
ethane;[(E)-3-phenylprop-1-enyl]benzene
CID 143041114
[(E)-2-methyl-5-phenylpent-4-en-2-yl]benzene
CID 5370792
1-[(1E)-1-(1,3-dimethyl-1-prop-2-enylbenzo[e]indol-2-ylidene)-3-methylhex-5-en-3-yl]-N-methylnaphthalen-2-amine
CID 143551533
[(E)-4-isocyano-4-methylpent-1-enyl]benzene
CID 58555273

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine?
The IUPAC name of N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine (CID 143655801) is N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine.
What is the SMILES notation for N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine?
The canonical SMILES for N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine is CNc1ccc2ccccc2c1C(C)(C/C=C/c1ccccc1)Cc1ccccc1.
What is the InChIKey of N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine?
The InChIKey is XDLZKNVVFVMGIW-LFIBNONCSA-N. The full InChI is InChI=1S/C29H29N/c1-29(22-24-14-7-4-8-15-24,21-11-16-23-12-5-3-6-13-23)28-26-18-10-9-17-25(26)19-20-27(28)30-2/h3-20,30H,21-22H2,1-2H3/b16-11+.
What are the key properties of N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine?
N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine has a molecular weight of 391.56 g/mol, XLogP of 7.49, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine is sourced from PubChem (CID 143655801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).