N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine

C13H28N2 — CID 83909799

IUPACN,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine
SMILESCC(C)C(CCN(C)C)C1CCNCC1
InChIInChI=1S/C13H28N2/c1-11(2)13(7-10-15(3)4)12-5-8-14-9-6-12/h11-14H,5-10H2,1-4H3
InChIKeyHFQIUBJIILLBCC-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.21
Rot. Bonds5

About N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine

N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine (PubChem CID 83909799) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine.

Molecular Properties

Compound NameN,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine
PubChem CID83909799
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine
SMILESCC(C)C(CCN(C)C)C1CCNCC1
InChIInChI=1S/C13H28N2/c1-11(2)13(7-10-15(3)4)12-5-8-14-9-6-12/h11-14H,5-10H2,1-4H3
InChIKeyHFQIUBJIILLBCC-UHFFFAOYSA-N
XLogP2.21
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-2-piperidin-4-ylbutan-1-amine
CID 82598281
4-[(2R)-3,3-dimethylbutan-2-yl]piperidine
CID 146228118
4-[(2S)-3-methylbutan-2-yl]piperidine
CID 126758303
N,N-dimethyl-2-piperidin-4-ylbutan-1-amine
CID 19965474
4-(3,4-dimethylpentan-2-yl)piperidine
CID 131198320
N-methyl-N-(1-piperidin-4-ylethyl)cyclobutanamine
CID 131036657
4-[(1R)-1-fluoroethyl]piperidine
CID 124547551
4-(1-fluoro-4-methylpentyl)piperidine
CID 112563624
4-[(2R)-butan-2-yl]piperidine;ethane
CID 142032949
N-methyl-N-(3-methylpentyl)piperidin-4-amine
CID 139366215
4-heptan-2-ylpiperidine
CID 143122379
N,3-dimethyl-N-(piperidin-4-ylmethyl)butan-2-amine
CID 43570215

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine?
The IUPAC name of N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine (CID 83909799) is N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine.
What is the SMILES notation for N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine?
The canonical SMILES for N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine is CC(C)C(CCN(C)C)C1CCNCC1.
What is the InChIKey of N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine?
The InChIKey is HFQIUBJIILLBCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-11(2)13(7-10-15(3)4)12-5-8-14-9-6-12/h11-14H,5-10H2,1-4H3.
What are the key properties of N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine?
N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-3-piperidin-4-ylpentan-1-amine is sourced from PubChem (CID 83909799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).