N-(6-methylundecan-6-yl)cyclopentanamine

C17H35N — CID 134356805

IUPACN-(6-methylundecan-6-yl)cyclopentanamine
SMILESCCCCCC(C)(CCCCC)NC1CCCC1
InChIInChI=1S/C17H35N/c1-4-6-10-14-17(3,15-11-7-5-2)18-16-12-8-9-13-16/h16,18H,4-15H2,1-3H3
InChIKeyDVIHHSOXTRMHGN-UHFFFAOYSA-N
MW253.47 g/mol
LogP5.44
Rot. Bonds10

About N-(6-methylundecan-6-yl)cyclopentanamine

N-(6-methylundecan-6-yl)cyclopentanamine (PubChem CID 134356805) has the molecular formula C17H35N and a molecular weight of 253.47 g/mol. Its IUPAC name is N-(6-methylundecan-6-yl)cyclopentanamine.

Molecular Properties

Compound NameN-(6-methylundecan-6-yl)cyclopentanamine
PubChem CID134356805
Molecular FormulaC17H35N
Molecular Weight253.47 g/mol
Exact Mass253.28
IUPAC NameN-(6-methylundecan-6-yl)cyclopentanamine
SMILESCCCCCC(C)(CCCCC)NC1CCCC1
InChIInChI=1S/C17H35N/c1-4-6-10-14-17(3,15-11-7-5-2)18-16-12-8-9-13-16/h16,18H,4-15H2,1-3H3
InChIKeyDVIHHSOXTRMHGN-UHFFFAOYSA-N
XLogP5.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500253.47
LogP ≤ 55.44
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

N-(4-methyldecan-4-yl)cyclohexanamine
CID 139320113
2-(cyclohexylamino)-2-methylheptan-1-ol
CID 80558659
N-(6-methyltridecan-6-yl)piperidin-4-amine
CID 175625026
1-methyl-N-(3-methylnonan-3-yl)piperidin-4-amine
CID 129254171
2-(cycloheptylamino)-2-methylnonanamide
CID 60998647
N-(6-methyldodecan-6-yl)-1-methylsulfonylazetidin-3-amine
CID 146436756
N-(2-methylnonan-2-yl)piperidin-4-amine
CID 167126912
4-(2-aminoethyl)-N-(4-methylheptan-4-yl)cyclohexan-1-amine
CID 175630753
N-(1-chloro-2-methylbutan-2-yl)cyclohexanamine
CID 82937345
2-(cyclopropylamino)-2-methyl-5-[pentyl(propan-2-yl)amino]pentan-1-ol
CID 64827354
1-cyclopentyl-3-methyloctan-3-ol
CID 142057645
[2-[(1-amino-2-methyloctan-2-yl)amino]cyclohexyl]methanol
CID 106360327

Frequently Asked Questions

What is the IUPAC name of N-(6-methylundecan-6-yl)cyclopentanamine?
The IUPAC name of N-(6-methylundecan-6-yl)cyclopentanamine (CID 134356805) is N-(6-methylundecan-6-yl)cyclopentanamine.
What is the SMILES notation for N-(6-methylundecan-6-yl)cyclopentanamine?
The canonical SMILES for N-(6-methylundecan-6-yl)cyclopentanamine is CCCCCC(C)(CCCCC)NC1CCCC1.
What is the InChIKey of N-(6-methylundecan-6-yl)cyclopentanamine?
The InChIKey is DVIHHSOXTRMHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N/c1-4-6-10-14-17(3,15-11-7-5-2)18-16-12-8-9-13-16/h16,18H,4-15H2,1-3H3.
What are the key properties of N-(6-methylundecan-6-yl)cyclopentanamine?
N-(6-methylundecan-6-yl)cyclopentanamine has a molecular weight of 253.47 g/mol, XLogP of 5.44, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methylundecan-6-yl)cyclopentanamine is sourced from PubChem (CID 134356805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).