2,6-dimethyl-1-phenylheptan-1-amine

C15H25N — CID 104845216

IUPAC2,6-dimethyl-1-phenylheptan-1-amine
SMILESCC(C)CCCC(C)C(N)c1ccccc1
InChIInChI=1S/C15H25N/c1-12(2)8-7-9-13(3)15(16)14-10-5-4-6-11-14/h4-6,10-13,15H,7-9,16H2,1-3H3
InChIKeyADMCSLMTWQSGKR-UHFFFAOYSA-N
MW219.37 g/mol
LogP4.15
Rot. Bonds6

About 2,6-dimethyl-1-phenylheptan-1-amine

2,6-dimethyl-1-phenylheptan-1-amine (PubChem CID 104845216) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 2,6-dimethyl-1-phenylheptan-1-amine.

Molecular Properties

Compound Name2,6-dimethyl-1-phenylheptan-1-amine
PubChem CID104845216
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name2,6-dimethyl-1-phenylheptan-1-amine
SMILESCC(C)CCCC(C)C(N)c1ccccc1
InChIInChI=1S/C15H25N/c1-12(2)8-7-9-13(3)15(16)14-10-5-4-6-11-14/h4-6,10-13,15H,7-9,16H2,1-3H3
InChIKeyADMCSLMTWQSGKR-UHFFFAOYSA-N
XLogP4.15
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-4-methyl-1-phenylpentan-1-amine
CID 28780030
N',N',2-trimethyl-1-phenylpropane-1,3-diamine
CID 62618546
2-methyl-1-phenyl-4-propan-2-yloxybutan-1-amine
CID 104845224
5-methyl-1-phenylhexan-1-ol
CID 10997859
2-methyl-1-phenyl-5-(2,2,2-trifluoroethoxy)pentan-1-amine
CID 104845241
N'-ethyl-2-methyl-N'-(2-methylpropyl)-1-phenylpropane-1,3-diamine
CID 62618547
(1S,2S)-2-N-methyl-1-phenylpropane-1,2-diamine
CID 6711442
(1R,2R)-2-N-methyl-1-phenylpropane-1,2-diamine
CID 59302389
2-methyl-1-(4-phenylphenyl)pentan-1-amine
CID 43094240
2-N,2-N-bis(2-methylpropyl)-1-phenylpropane-1,2-diamine
CID 61377500
2-(3-methylbutoxy)-1,2-diphenylethanamine
CID 43104834
2-[(3-amino-2-methyl-3-phenylpropyl)-(2-hydroxyethyl)amino]ethanol
CID 62619271

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-1-phenylheptan-1-amine?
The IUPAC name of 2,6-dimethyl-1-phenylheptan-1-amine (CID 104845216) is 2,6-dimethyl-1-phenylheptan-1-amine.
What is the SMILES notation for 2,6-dimethyl-1-phenylheptan-1-amine?
The canonical SMILES for 2,6-dimethyl-1-phenylheptan-1-amine is CC(C)CCCC(C)C(N)c1ccccc1.
What is the InChIKey of 2,6-dimethyl-1-phenylheptan-1-amine?
The InChIKey is ADMCSLMTWQSGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-12(2)8-7-9-13(3)15(16)14-10-5-4-6-11-14/h4-6,10-13,15H,7-9,16H2,1-3H3.
What are the key properties of 2,6-dimethyl-1-phenylheptan-1-amine?
2,6-dimethyl-1-phenylheptan-1-amine has a molecular weight of 219.37 g/mol, XLogP of 4.15, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-1-phenylheptan-1-amine is sourced from PubChem (CID 104845216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).