1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine

C15H32N2 — CID 62042262

IUPAC1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine
SMILESCCCNC(CCC)CN1CC(C)CC(C)C1
InChIInChI=1S/C15H32N2/c1-5-7-15(16-8-6-2)12-17-10-13(3)9-14(4)11-17/h13-16H,5-12H2,1-4H3
InChIKeyKRSWVVPHGPUJNG-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.13
Rot. Bonds7

About 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine

1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine (PubChem CID 62042262) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine.

Molecular Properties

Compound Name1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine
PubChem CID62042262
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine
SMILESCCCNC(CCC)CN1CC(C)CC(C)C1
InChIInChI=1S/C15H32N2/c1-5-7-15(16-8-6-2)12-17-10-13(3)9-14(4)11-17/h13-16H,5-12H2,1-4H3
InChIKeyKRSWVVPHGPUJNG-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-1-[2-(propylamino)pentyl]piperidin-4-amine
CID 62043146
N-ethyl-1-(3-methylpyrrolidin-1-yl)pentan-2-amine
CID 62044690
4-methyl-1-[2-(propylamino)pentyl]piperidine-2,6-dione
CID 79506645
1-[3-(methoxymethyl)pyrrolidin-1-yl]-N-propylpentan-2-amine
CID 64569510
1-(4,4-diethylpiperidin-1-yl)-N-propylpentan-2-amine
CID 63468589
1-(4-ethyl-4-methylpiperidin-1-yl)-N-propylpentan-2-amine
CID 63468229
N-ethyl-1-(3-methylpiperidin-1-yl)pentan-2-amine
CID 62041614
1-(8-azaspiro[4.5]decan-8-yl)-N-propylpentan-2-amine
CID 63469319
1-(4-methylcyclohexyl)oxy-N-propylpentan-2-amine
CID 62041478
1-methoxy-N-propyl-3-(2,3,5-trimethylpiperidin-1-yl)propan-2-amine
CID 107505960
1-[3-(methoxymethyl)piperidin-1-yl]-N-propylpentan-2-amine
CID 106586522
N,N,4-trimethyl-1-[2-(propylamino)butyl]pyrrolidin-3-amine
CID 81465085

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine?
The IUPAC name of 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine (CID 62042262) is 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine.
What is the SMILES notation for 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine?
The canonical SMILES for 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine is CCCNC(CCC)CN1CC(C)CC(C)C1.
What is the InChIKey of 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine?
The InChIKey is KRSWVVPHGPUJNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-5-7-15(16-8-6-2)12-17-10-13(3)9-14(4)11-17/h13-16H,5-12H2,1-4H3.
What are the key properties of 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine?
1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine has a molecular weight of 240.43 g/mol, XLogP of 3.13, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylpiperidin-1-yl)-N-propylpentan-2-amine is sourced from PubChem (CID 62042262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).