N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine

C16H34N2 — CID 62212514

IUPACN,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine
SMILESCCC(CC)CN(CC)CCCC1CCNCC1
InChIInChI=1S/C16H34N2/c1-4-15(5-2)14-18(6-3)13-7-8-16-9-11-17-12-10-16/h15-17H,4-14H2,1-3H3
InChIKeyTWIGUYFQNUONGO-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.52
Rot. Bonds9

About N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine

N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine (PubChem CID 62212514) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine.

Molecular Properties

Compound NameN,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine
PubChem CID62212514
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC NameN,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine
SMILESCCC(CC)CN(CC)CCCC1CCNCC1
InChIInChI=1S/C16H34N2/c1-4-15(5-2)14-18(6-3)13-7-8-16-9-11-17-12-10-16/h15-17H,4-14H2,1-3H3
InChIKeyTWIGUYFQNUONGO-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-4-piperidin-4-ylbutan-1-amine
CID 10081918
N'-ethyl-N,N-dimethyl-N'-(3-piperidin-4-ylpropyl)propane-1,3-diamine
CID 102994383
5-[ethyl(2-ethylbutyl)amino]-2,2-dimethylpentanenitrile
CID 65257246
N,2-diethyl-N-[(2-methylpiperidin-4-yl)methyl]butan-1-amine
CID 106740959
2-ethyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylbutan-1-amine
CID 79716141
N,N-diethyl-2-(2-piperidin-4-ylethoxy)ethanamine
CID 15057325
N-butyl-N-(3-piperidin-4-ylpropyl)cyclopropanamine
CID 62212523
N-ethyl-N-(piperidin-4-ylmethyl)hexan-1-amine
CID 79715887
N-ethyl-N-methyl-2-piperidin-4-ylethanamine
CID 43263497
ethane;4-propylpiperidine
CID 142071399
N-[3-(diethylamino)propyl]-N-ethyl-3-piperidin-4-ylpropanamide
CID 102992986
N-ethyl-2-methyl-N-[3-(1-propan-2-ylpiperidin-4-yl)propyl]propan-1-amine
CID 167231530

Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine?
The IUPAC name of N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine (CID 62212514) is N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine.
What is the SMILES notation for N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine?
The canonical SMILES for N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine is CCC(CC)CN(CC)CCCC1CCNCC1.
What is the InChIKey of N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine?
The InChIKey is TWIGUYFQNUONGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-4-15(5-2)14-18(6-3)13-7-8-16-9-11-17-12-10-16/h15-17H,4-14H2,1-3H3.
What are the key properties of N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine?
N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.52, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-N-(3-piperidin-4-ylpropyl)butan-1-amine is sourced from PubChem (CID 62212514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).