N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine

C15H32N2 — CID 62575588

IUPACN-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine
SMILESCCC1CCCCN1CCNCCCC(C)C
InChIInChI=1S/C15H32N2/c1-4-15-9-5-6-12-17(15)13-11-16-10-7-8-14(2)3/h14-16H,4-13H2,1-3H3
InChIKeySSICBHCBUMJLAM-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.28
Rot. Bonds8

About N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine

N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine (PubChem CID 62575588) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine.

Molecular Properties

Compound NameN-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine
PubChem CID62575588
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine
SMILESCCC1CCCCN1CCNCCCC(C)C
InChIInChI=1S/C15H32N2/c1-4-15-9-5-6-12-17(15)13-11-16-10-7-8-14(2)3/h14-16H,4-13H2,1-3H3
InChIKeySSICBHCBUMJLAM-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-ethylpiperidin-1-yl)ethyl]-3-methoxypropan-1-amine
CID 62575422
4-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]pentan-1-amine
CID 62414508
N-[2-(2-ethylazepan-1-yl)ethyl]pentan-2-amine
CID 113442007
N-ethyl-4-(2-ethylazepan-1-yl)butan-1-amine
CID 104692289
3-(2-ethylpyrrolidin-1-yl)-N-propylpropan-1-amine
CID 61386205
N-[2-(2-ethylpiperidin-1-yl)ethyl]-2,2,2-trifluoroethanamine
CID 62575268
4-(2-ethylazepan-1-yl)-N-propylbutan-2-amine
CID 104689484
N-[2-(azepan-1-yl)ethyl]-4-methylpentan-1-amine
CID 62575903
7-methyl-N-[2-(1-methylpiperidin-2-yl)ethyl]octan-1-amine
CID 103604979
N-(2-methylpropyl)-5-(2-propylpiperidin-1-yl)pentan-1-amine
CID 83061694
5-(2-ethylpiperidin-1-yl)-2-methylpentan-1-amine
CID 82016951
N-[3-[(2S)-2-ethylpiperidin-1-yl]propyl]-2-methylpropanamide
CID 99866850

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine?
The IUPAC name of N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine (CID 62575588) is N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine.
What is the SMILES notation for N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine?
The canonical SMILES for N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine is CCC1CCCCN1CCNCCCC(C)C.
What is the InChIKey of N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine?
The InChIKey is SSICBHCBUMJLAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-4-15-9-5-6-12-17(15)13-11-16-10-7-8-14(2)3/h14-16H,4-13H2,1-3H3.
What are the key properties of N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine?
N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine has a molecular weight of 240.43 g/mol, XLogP of 3.28, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethylpiperidin-1-yl)ethyl]-4-methylpentan-1-amine is sourced from PubChem (CID 62575588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).