N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine

C12H24N2 — CID 115211136

IUPACN-(cyclobutylmethyl)-2-piperidin-2-ylethanamine
SMILESC1CCC(CCNCC2CCC2)NC1
InChIInChI=1S/C12H24N2/c1-2-8-14-12(6-1)7-9-13-10-11-4-3-5-11/h11-14H,1-10H2
InChIKeyJMMMZOJSNDJEPF-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.91
Rot. Bonds5

About N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine

N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine (PubChem CID 115211136) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-2-piperidin-2-ylethanamine
PubChem CID115211136
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-(cyclobutylmethyl)-2-piperidin-2-ylethanamine
SMILESC1CCC(CCNCC2CCC2)NC1
InChIInChI=1S/C12H24N2/c1-2-8-14-12(6-1)7-9-13-10-11-4-3-5-11/h11-14H,1-10H2
InChIKeyJMMMZOJSNDJEPF-UHFFFAOYSA-N
XLogP1.91
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopentyl-N-(2-piperidin-2-ylethyl)ethanamine
CID 115211186
1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine
CID 106633110
2-cyclohexyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106633611
N,N'-bis(2-piperidin-2-ylethyl)propane-1,3-diamine
CID 18940745
N-(cyclobutylmethyl)-2-cyclohexylethanamine
CID 65457561
N-methyl-2-piperidin-2-ylethanamine
CID 13073020
2-[(2S)-piperidin-2-yl]ethanol;hydrochloride
CID 53487138
2-cyclononyl-N-(cyclononylmethyl)ethanamine
CID 91347612
3-(piperidin-2-ylmethylamino)propan-1-ol
CID 106633028
1-(1-methylpiperidin-4-yl)-N-(piperidin-2-ylmethyl)methanamine
CID 106633809
ethane;2-piperidin-2-ylethanol
CID 91203064
2-(1-methylpiperidin-3-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 115208430

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine?
The IUPAC name of N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine (CID 115211136) is N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine.
What is the SMILES notation for N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine?
The canonical SMILES for N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine is C1CCC(CCNCC2CCC2)NC1.
What is the InChIKey of N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine?
The InChIKey is JMMMZOJSNDJEPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-2-8-14-12(6-1)7-9-13-10-11-4-3-5-11/h11-14H,1-10H2.
What are the key properties of N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine?
N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine has a molecular weight of 196.34 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-2-piperidin-2-ylethanamine is sourced from PubChem (CID 115211136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).