2-(2-chlorophenyl)nonan-1-amine

C15H24ClN — CID 79448666

IUPAC2-(2-chlorophenyl)nonan-1-amine
SMILESCCCCCCCC(CN)c1ccccc1Cl
InChIInChI=1S/C15H24ClN/c1-2-3-4-5-6-9-13(12-17)14-10-7-8-11-15(14)16/h7-8,10-11,13H,2-6,9,12,17H2,1H3
InChIKeyNASQAVCMMNDQHA-UHFFFAOYSA-N
MW253.82 g/mol
LogP4.74
Rot. Bonds8

About 2-(2-chlorophenyl)nonan-1-amine

2-(2-chlorophenyl)nonan-1-amine (PubChem CID 79448666) has the molecular formula C15H24ClN and a molecular weight of 253.82 g/mol. Its IUPAC name is 2-(2-chlorophenyl)nonan-1-amine.

Molecular Properties

Compound Name2-(2-chlorophenyl)nonan-1-amine
PubChem CID79448666
Molecular FormulaC15H24ClN
Molecular Weight253.82 g/mol
Exact Mass253.16
IUPAC Name2-(2-chlorophenyl)nonan-1-amine
SMILESCCCCCCCC(CN)c1ccccc1Cl
InChIInChI=1S/C15H24ClN/c1-2-3-4-5-6-9-13(12-17)14-10-7-8-11-15(14)16/h7-8,10-11,13H,2-6,9,12,17H2,1H3
InChIKeyNASQAVCMMNDQHA-UHFFFAOYSA-N
XLogP4.74
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.82
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methylphenyl)decan-1-amine
CID 79421405
2-(2-chlorophenyl)decan-1-ol;methanesulfonic acid
CID 88842519
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CID 62606389
2-phenylundecan-1-amine
CID 57256894
2-(2-chlorophenyl)-5-(2-methoxyethoxy)pentan-1-amine
CID 103412655
2-(2-chlorophenyl)-2-hexoxyethanamine
CID 55022815
2-(4-chlorophenyl)dodecan-1-amine
CID 79441361
2-icosan-9-ylaniline
CID 22408958
2-(2-methoxyphenyl)hexan-1-amine
CID 84753039
2-(2-chlorophenyl)-4-(3-methylbutoxy)butan-1-amine
CID 79449337
1-(2,3-dichlorophenyl)undecan-1-amine
CID 115846022
2-pentadecan-6-ylphenol
CID 66865451

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)nonan-1-amine?
The IUPAC name of 2-(2-chlorophenyl)nonan-1-amine (CID 79448666) is 2-(2-chlorophenyl)nonan-1-amine.
What is the SMILES notation for 2-(2-chlorophenyl)nonan-1-amine?
The canonical SMILES for 2-(2-chlorophenyl)nonan-1-amine is CCCCCCCC(CN)c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)nonan-1-amine?
The InChIKey is NASQAVCMMNDQHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24ClN/c1-2-3-4-5-6-9-13(12-17)14-10-7-8-11-15(14)16/h7-8,10-11,13H,2-6,9,12,17H2,1H3.
What are the key properties of 2-(2-chlorophenyl)nonan-1-amine?
2-(2-chlorophenyl)nonan-1-amine has a molecular weight of 253.82 g/mol, XLogP of 4.74, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)nonan-1-amine is sourced from PubChem (CID 79448666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).