N-methyl-1,5-diphenylheptan-4-amine

C20H27N — CID 115849452

IUPACN-methyl-1,5-diphenylheptan-4-amine
SMILESCCC(c1ccccc1)C(CCCc1ccccc1)NC
InChIInChI=1S/C20H27N/c1-3-19(18-14-8-5-9-15-18)20(21-2)16-10-13-17-11-6-4-7-12-17/h4-9,11-12,14-15,19-21H,3,10,13,16H2,1-2H3
InChIKeyISYYFFYFIUWMLR-UHFFFAOYSA-N
MW281.44 g/mol
LogP4.79
Rot. Bonds8

About N-methyl-1,5-diphenylheptan-4-amine

N-methyl-1,5-diphenylheptan-4-amine (PubChem CID 115849452) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is N-methyl-1,5-diphenylheptan-4-amine.

Molecular Properties

Compound NameN-methyl-1,5-diphenylheptan-4-amine
PubChem CID115849452
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC NameN-methyl-1,5-diphenylheptan-4-amine
SMILESCCC(c1ccccc1)C(CCCc1ccccc1)NC
InChIInChI=1S/C20H27N/c1-3-19(18-14-8-5-9-15-18)20(21-2)16-10-13-17-11-6-4-7-12-17/h4-9,11-12,14-15,19-21H,3,10,13,16H2,1-2H3
InChIKeyISYYFFYFIUWMLR-UHFFFAOYSA-N
XLogP4.79
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-4-phenyl-1-thiophen-3-ylhexan-3-amine
CID 115856961
N,3-dimethyl-6-phenylhexan-2-amine
CID 61485141
N-methyl-3-phenyl-1-thiophen-3-ylpentan-2-amine
CID 115845128
[(2R)-5-phenylpentan-2-yl]benzene
CID 143889057
1-cyclopropyl-1-methoxy-N-methyl-5-phenylpentan-2-amine
CID 116722293
1-(2,6-difluorophenyl)-N-methyl-3-phenylpentan-2-amine
CID 105055608
N-ethyl-3-phenylheptan-4-amine
CID 83051533
N-methyl-5-phenyl-1-propan-2-ylsulfanylpentan-2-amine
CID 65131659
1-(4-butylphenyl)-2-phenylbutan-1-ol
CID 63427121
2-(methylaminomethyl)-1,3,6-triphenylhexan-1-one;hydrochloride
CID 141033404
(1R)-1,4-diphenylbutan-1-amine
CID 7131342
5-methylheptylbenzene
CID 564254

Frequently Asked Questions

What is the IUPAC name of N-methyl-1,5-diphenylheptan-4-amine?
The IUPAC name of N-methyl-1,5-diphenylheptan-4-amine (CID 115849452) is N-methyl-1,5-diphenylheptan-4-amine.
What is the SMILES notation for N-methyl-1,5-diphenylheptan-4-amine?
The canonical SMILES for N-methyl-1,5-diphenylheptan-4-amine is CCC(c1ccccc1)C(CCCc1ccccc1)NC.
What is the InChIKey of N-methyl-1,5-diphenylheptan-4-amine?
The InChIKey is ISYYFFYFIUWMLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-3-19(18-14-8-5-9-15-18)20(21-2)16-10-13-17-11-6-4-7-12-17/h4-9,11-12,14-15,19-21H,3,10,13,16H2,1-2H3.
What are the key properties of N-methyl-1,5-diphenylheptan-4-amine?
N-methyl-1,5-diphenylheptan-4-amine has a molecular weight of 281.44 g/mol, XLogP of 4.79, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1,5-diphenylheptan-4-amine is sourced from PubChem (CID 115849452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).