N-(6-methyltridecan-6-yl)piperidin-4-amine

C19H40N2 — CID 175625026

IUPACN-(6-methyltridecan-6-yl)piperidin-4-amine
SMILESCCCCCCCC(C)(CCCCC)NC1CCNCC1
InChIInChI=1S/C19H40N2/c1-4-6-8-9-11-15-19(3,14-10-7-5-2)21-18-12-16-20-17-13-18/h18,20-21H,4-17H2,1-3H3
InChIKeyIXWVRSRBRCDCNR-UHFFFAOYSA-N
MW296.54 g/mol
LogP5.03
Rot. Bonds12

About N-(6-methyltridecan-6-yl)piperidin-4-amine

N-(6-methyltridecan-6-yl)piperidin-4-amine (PubChem CID 175625026) has the molecular formula C19H40N2 and a molecular weight of 296.54 g/mol. Its IUPAC name is N-(6-methyltridecan-6-yl)piperidin-4-amine.

Molecular Properties

Compound NameN-(6-methyltridecan-6-yl)piperidin-4-amine
PubChem CID175625026
Molecular FormulaC19H40N2
Molecular Weight296.54 g/mol
Exact Mass296.32
IUPAC NameN-(6-methyltridecan-6-yl)piperidin-4-amine
SMILESCCCCCCCC(C)(CCCCC)NC1CCNCC1
InChIInChI=1S/C19H40N2/c1-4-6-8-9-11-15-19(3,14-10-7-5-2)21-18-12-16-20-17-13-18/h18,20-21H,4-17H2,1-3H3
InChIKeyIXWVRSRBRCDCNR-UHFFFAOYSA-N
XLogP5.03
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.54
LogP ≤ 55.03
H-Bond Donors ≤ 52
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-methylnonan-2-yl)piperidin-4-amine
CID 167126912
N-(6-methylundecan-6-yl)cyclopentanamine
CID 134356805
N-(4-methyldecan-4-yl)cyclohexanamine
CID 139320113
2-(cyclohexylamino)-2-methylheptan-1-ol
CID 80558659
1-methyl-N-(3-methylnonan-3-yl)piperidin-4-amine
CID 129254171
4-hexadecylpiperidine
CID 54096875
4-(8-methylpentadecan-8-yl)piperidine
CID 167069655
4-heptylpiperidine;methane
CID 144690559
N-(6-methyldodecan-6-yl)-1-methylsulfonylazetidin-3-amine
CID 146436756
1-pentadecyl-N-piperidin-4-ylpiperidin-4-amine
CID 11641883
N-(2-methylhexan-2-yl)pyrrolidin-3-amine
CID 139362773
N-(6,6-dimethylheptyl)piperidin-4-amine
CID 170373818

Frequently Asked Questions

What is the IUPAC name of N-(6-methyltridecan-6-yl)piperidin-4-amine?
The IUPAC name of N-(6-methyltridecan-6-yl)piperidin-4-amine (CID 175625026) is N-(6-methyltridecan-6-yl)piperidin-4-amine.
What is the SMILES notation for N-(6-methyltridecan-6-yl)piperidin-4-amine?
The canonical SMILES for N-(6-methyltridecan-6-yl)piperidin-4-amine is CCCCCCCC(C)(CCCCC)NC1CCNCC1.
What is the InChIKey of N-(6-methyltridecan-6-yl)piperidin-4-amine?
The InChIKey is IXWVRSRBRCDCNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40N2/c1-4-6-8-9-11-15-19(3,14-10-7-5-2)21-18-12-16-20-17-13-18/h18,20-21H,4-17H2,1-3H3.
What are the key properties of N-(6-methyltridecan-6-yl)piperidin-4-amine?
N-(6-methyltridecan-6-yl)piperidin-4-amine has a molecular weight of 296.54 g/mol, XLogP of 5.03, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyltridecan-6-yl)piperidin-4-amine is sourced from PubChem (CID 175625026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).