N,5-dimethyl-3-piperidin-1-ylhexan-1-amine

C13H28N2 — CID 112517776

IUPACN,5-dimethyl-3-piperidin-1-ylhexan-1-amine
SMILESCNCCC(CC(C)C)N1CCCCC1
InChIInChI=1S/C13H28N2/c1-12(2)11-13(7-8-14-3)15-9-5-4-6-10-15/h12-14H,4-11H2,1-3H3
InChIKeyLPFSAPNQCGXECB-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.50
Rot. Bonds6

About N,5-dimethyl-3-piperidin-1-ylhexan-1-amine

N,5-dimethyl-3-piperidin-1-ylhexan-1-amine (PubChem CID 112517776) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N,5-dimethyl-3-piperidin-1-ylhexan-1-amine.

Molecular Properties

Compound NameN,5-dimethyl-3-piperidin-1-ylhexan-1-amine
PubChem CID112517776
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN,5-dimethyl-3-piperidin-1-ylhexan-1-amine
SMILESCNCCC(CC(C)C)N1CCCCC1
InChIInChI=1S/C13H28N2/c1-12(2)11-13(7-8-14-3)15-9-5-4-6-10-15/h12-14H,4-11H2,1-3H3
InChIKeyLPFSAPNQCGXECB-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,4-dimethyl-2-pyrrolidin-1-ylpentan-1-amine
CID 19439849
2-(azepan-1-yl)-4-methylpentan-1-ol
CID 104549268
6-methyl-4-piperidin-1-ylheptanoic acid
CID 112517978
6-methyl-4-pyrrolidin-1-ylheptanoic acid
CID 112517782
(3S)-4-(4-chlorophenyl)-N-methyl-3-piperidin-1-ylbutan-1-amine
CID 164673614
1-(4-methylpentan-2-yl)pyrrolidine
CID 59761841
1-(4-piperidin-1-ylpentan-2-yl)piperidine
CID 174442116
N-(4-methyl-2-pyrrolidin-1-ylpentyl)propane-1-sulfonamide
CID 110403539
1-[1-(2,6-dimethylheptan-4-yl)pyrrolidin-3-yl]-N-methylmethanamine
CID 114868388
2-(azepan-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 62437423
1-(18-methylnonadecan-6-yl)pyrrolidine
CID 69395042
1-(23-methyltetracosan-7-yl)pyrrolidine
CID 69388285

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-3-piperidin-1-ylhexan-1-amine?
The IUPAC name of N,5-dimethyl-3-piperidin-1-ylhexan-1-amine (CID 112517776) is N,5-dimethyl-3-piperidin-1-ylhexan-1-amine.
What is the SMILES notation for N,5-dimethyl-3-piperidin-1-ylhexan-1-amine?
The canonical SMILES for N,5-dimethyl-3-piperidin-1-ylhexan-1-amine is CNCCC(CC(C)C)N1CCCCC1.
What is the InChIKey of N,5-dimethyl-3-piperidin-1-ylhexan-1-amine?
The InChIKey is LPFSAPNQCGXECB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-12(2)11-13(7-8-14-3)15-9-5-4-6-10-15/h12-14H,4-11H2,1-3H3.
What are the key properties of N,5-dimethyl-3-piperidin-1-ylhexan-1-amine?
N,5-dimethyl-3-piperidin-1-ylhexan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-3-piperidin-1-ylhexan-1-amine is sourced from PubChem (CID 112517776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).