4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine

C18H29N — CID 43761510

IUPAC4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine
SMILESCCCCC(NC1CCC(C)CC1)c1ccccc1
InChIInChI=1S/C18H29N/c1-3-4-10-18(16-8-6-5-7-9-16)19-17-13-11-15(2)12-14-17/h5-9,15,17-19H,3-4,10-14H2,1-2H3
InChIKeyLQDWZOQLXMKSSB-UHFFFAOYSA-N
MW259.44 g/mol
LogP5.09
Rot. Bonds6

About 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine

4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine (PubChem CID 43761510) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine
PubChem CID43761510
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC Name4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine
SMILESCCCCC(NC1CCC(C)CC1)c1ccccc1
InChIInChI=1S/C18H29N/c1-3-4-10-18(16-8-6-5-7-9-16)19-17-13-11-15(2)12-14-17/h5-9,15,17-19H,3-4,10-14H2,1-2H3
InChIKeyLQDWZOQLXMKSSB-UHFFFAOYSA-N
XLogP5.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.44
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(4-methylcyclohexyl)amino]-4-phenylbutan-1-ol
CID 111467264
4-N-(1-phenylpentyl)cyclohexane-1,4-diamine
CID 62319614
N-(1-phenylpentyl)cycloheptanamine
CID 43767069
4-(1-phenylpentylamino)pyrrolidin-2-one
CID 106183225
N-benzhydryl-4-methylcyclohexan-1-amine
CID 43079012
1-ethyl-N-(1-phenylbutyl)piperidin-4-amine
CID 43224635
(1S)-N-methyl-1-phenylpentan-1-amine
CID 86314170
N-(1-phenylbutyl)-1-propan-2-ylpiperidin-4-amine
CID 43182970
4-ethyl-N-(1-phenylpropyl)cyclohexan-1-amine
CID 55194080
(2S)-2-(cyclopropylamino)-2-phenylethanol
CID 93471499
[(1S)-1-phenylpentyl]hydrazine
CID 124537681
1-[4-(1-phenylbutylamino)piperidin-1-yl]ethanone
CID 43224633

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine?
The IUPAC name of 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine (CID 43761510) is 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine.
What is the SMILES notation for 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine?
The canonical SMILES for 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine is CCCCC(NC1CCC(C)CC1)c1ccccc1.
What is the InChIKey of 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine?
The InChIKey is LQDWZOQLXMKSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-3-4-10-18(16-8-6-5-7-9-16)19-17-13-11-15(2)12-14-17/h5-9,15,17-19H,3-4,10-14H2,1-2H3.
What are the key properties of 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine?
4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine has a molecular weight of 259.44 g/mol, XLogP of 5.09, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1-phenylpentyl)cyclohexan-1-amine is sourced from PubChem (CID 43761510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).