3-methyl-1-naphthalen-2-ylhexan-2-amine

C17H23N — CID 61080295

IUPAC3-methyl-1-naphthalen-2-ylhexan-2-amine
SMILESCCCC(C)C(N)Cc1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-3-6-13(2)17(18)12-14-9-10-15-7-4-5-8-16(15)11-14/h4-5,7-11,13,17H,3,6,12,18H2,1-2H3
InChIKeyLWMASNVHJNUBLB-UHFFFAOYSA-N
MW241.38 g/mol
LogP4.15
Rot. Bonds5

About 3-methyl-1-naphthalen-2-ylhexan-2-amine

3-methyl-1-naphthalen-2-ylhexan-2-amine (PubChem CID 61080295) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is 3-methyl-1-naphthalen-2-ylhexan-2-amine.

Molecular Properties

Compound Name3-methyl-1-naphthalen-2-ylhexan-2-amine
PubChem CID61080295
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC Name3-methyl-1-naphthalen-2-ylhexan-2-amine
SMILESCCCC(C)C(N)Cc1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-3-6-13(2)17(18)12-14-9-10-15-7-4-5-8-16(15)11-14/h4-5,7-11,13,17H,3,6,12,18H2,1-2H3
InChIKeyLWMASNVHJNUBLB-UHFFFAOYSA-N
XLogP4.15
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-propan-2-ylpentyl)naphthalene
CID 173217624
1-(3,4-dichlorophenyl)-3-methylhexan-2-amine
CID 63528315
3-methyl-1-naphthalen-1-ylhexan-2-amine
CID 61078654
2-methyl-3-naphthalen-2-ylpropane-1,1-diol
CID 20647932
(2R)-4-naphthalen-2-ylbutan-2-amine
CID 131577314
4-ethyl-3,4,5-trimethyl-1-naphthalen-2-ylhex-5-en-2-amine
CID 142223798
(2S)-3-naphthalen-2-ylpropane-1,2-diamine
CID 68655255
2-aminohexanoic acid;2-amino-3-naphthalen-2-ylpropanoic acid
CID 67173075
methyl 3-amino-2-hydroxy-4-naphthalen-2-ylbutanoate
CID 154647583
2-(2-chlorobutyl)naphthalene
CID 21490588
(1S)-1-naphthalen-2-ylbutan-1-amine
CID 55254735
1-(furan-3-yl)-3-methylhexan-2-amine
CID 105029905

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-naphthalen-2-ylhexan-2-amine?
The IUPAC name of 3-methyl-1-naphthalen-2-ylhexan-2-amine (CID 61080295) is 3-methyl-1-naphthalen-2-ylhexan-2-amine.
What is the SMILES notation for 3-methyl-1-naphthalen-2-ylhexan-2-amine?
The canonical SMILES for 3-methyl-1-naphthalen-2-ylhexan-2-amine is CCCC(C)C(N)Cc1ccc2ccccc2c1.
What is the InChIKey of 3-methyl-1-naphthalen-2-ylhexan-2-amine?
The InChIKey is LWMASNVHJNUBLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N/c1-3-6-13(2)17(18)12-14-9-10-15-7-4-5-8-16(15)11-14/h4-5,7-11,13,17H,3,6,12,18H2,1-2H3.
What are the key properties of 3-methyl-1-naphthalen-2-ylhexan-2-amine?
3-methyl-1-naphthalen-2-ylhexan-2-amine has a molecular weight of 241.38 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-naphthalen-2-ylhexan-2-amine is sourced from PubChem (CID 61080295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).