6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine

C16H33NO — CID 66321215

IUPAC6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine
SMILESCC(C)CNCCCCCCOCC1CCCC1
InChIInChI=1S/C16H33NO/c1-15(2)13-17-11-7-3-4-8-12-18-14-16-9-5-6-10-16/h15-17H,3-14H2,1-2H3
InChIKeyLQPMGSBSDUQESV-UHFFFAOYSA-N
MW255.45 g/mol
LogP4.00
Rot. Bonds11

About 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine

6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine (PubChem CID 66321215) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine.

Molecular Properties

Compound Name6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine
PubChem CID66321215
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC Name6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine
SMILESCC(C)CNCCCCCCOCC1CCCC1
InChIInChI=1S/C16H33NO/c1-15(2)13-17-11-7-3-4-8-12-18-14-16-9-5-6-10-16/h15-17H,3-14H2,1-2H3
InChIKeyLQPMGSBSDUQESV-UHFFFAOYSA-N
XLogP4.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methylpropyl)-5-(oxan-2-ylmethoxy)pentan-1-amine
CID 62443749
5-cyclohexyloxy-N-(2-methylpropyl)pentan-1-amine
CID 62443659
5-(cyclohexylmethoxy)-N-propylpentan-1-amine
CID 62485454
4-hexoxy-N-(2-methylpropyl)butan-1-amine
CID 62455139
4-(3-methylcyclohexyl)oxy-N-(2-methylpropyl)butan-1-amine
CID 62455906
4-ethoxy-N-(2-methylpropyl)butan-1-amine
CID 60957098
N-[2-(cyclopentylmethoxy)ethyl]-3-propan-2-yloxypropan-1-amine
CID 66323366
3-(cyclohexylmethoxy)-N-propan-2-ylpropan-1-amine
CID 62343201
N-[2-(cyclohexylmethoxy)ethyl]-3-methylbutan-1-amine
CID 62582719
N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 66321864
4-(4-methylpentoxy)-N-(2-methylpropyl)butan-1-amine
CID 62456980
6-[2-(3-methoxypropoxy)ethoxy]-N-(2-methylpropyl)hexan-1-amine
CID 103181280

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine?
The IUPAC name of 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine (CID 66321215) is 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine.
What is the SMILES notation for 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine?
The canonical SMILES for 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine is CC(C)CNCCCCCCOCC1CCCC1.
What is the InChIKey of 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine?
The InChIKey is LQPMGSBSDUQESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-15(2)13-17-11-7-3-4-8-12-18-14-16-9-5-6-10-16/h15-17H,3-14H2,1-2H3.
What are the key properties of 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine?
6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine has a molecular weight of 255.45 g/mol, XLogP of 4.00, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine is sourced from PubChem (CID 66321215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).