N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine

C13H28N2 — CID 79707694

IUPACN,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine
SMILESCCC(C(C)C)N(C)CC1CCNCC1
InChIInChI=1S/C13H28N2/c1-5-13(11(2)3)15(4)10-12-6-8-14-9-7-12/h11-14H,5-10H2,1-4H3
InChIKeyYEIUOSFUPVOXMZ-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.35
Rot. Bonds5

About N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine

N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine (PubChem CID 79707694) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine
PubChem CID79707694
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine
SMILESCCC(C(C)C)N(C)CC1CCNCC1
InChIInChI=1S/C13H28N2/c1-5-13(11(2)3)15(4)10-12-6-8-14-9-7-12/h11-14H,5-10H2,1-4H3
InChIKeyYEIUOSFUPVOXMZ-UHFFFAOYSA-N
XLogP2.35
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 ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,3-dimethyl-N-(piperidin-4-ylmethyl)butan-2-amine
CID 43570215
N-methyl-N-(piperidin-4-ylmethyl)heptan-2-amine
CID 80558048
(1S)-1-cyclohexyl-N-methyl-N-(piperidin-4-ylmethyl)ethanamine
CID 120848749
N-(piperidin-4-ylmethyl)-N-propan-2-ylpentan-3-amine
CID 79715856
N-(piperidin-4-ylmethyl)-N-propan-2-ylpropan-2-amine
CID 16768057
N,N-dimethyl-1-piperidin-4-ylmethanamine;dihydrochloride
CID 23153381
N-methyl-N-(piperidin-4-ylmethyl)thiohydroxylamine
CID 130458996
azane;N,N-dimethyl-1-piperidin-4-ylmethanamine
CID 175907731
1-(4-fluorophenyl)-N-methyl-N-(piperidin-4-ylmethyl)propan-1-amine
CID 79707251
1-(4-chlorophenyl)-N-methyl-N-(piperidin-4-ylmethyl)propan-2-amine
CID 103815876
2-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylbutan-1-amine
CID 79716141
N-methyl-4-phenyl-N-(piperidin-4-ylmethyl)butan-2-amine
CID 79707519

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine?
The IUPAC name of N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine (CID 79707694) is N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine.
What is the SMILES notation for N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine?
The canonical SMILES for N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine is CCC(C(C)C)N(C)CC1CCNCC1.
What is the InChIKey of N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine?
The InChIKey is YEIUOSFUPVOXMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-13(11(2)3)15(4)10-12-6-8-14-9-7-12/h11-14H,5-10H2,1-4H3.
What are the key properties of N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine?
N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine has a molecular weight of 212.38 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(piperidin-4-ylmethyl)pentan-3-amine is sourced from PubChem (CID 79707694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).