1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine

C15H30N2 — CID 83997264

IUPAC1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
SMILESCCC(C)N1CC(C)CC(NCC2CCC2)C1
InChIInChI=1S/C15H30N2/c1-4-13(3)17-10-12(2)8-15(11-17)16-9-14-6-5-7-14/h12-16H,4-11H2,1-3H3
InChIKeyGUGGJFJOWMFCNU-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds5

About 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine

1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine (PubChem CID 83997264) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine.

Molecular Properties

Compound Name1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
PubChem CID83997264
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
SMILESCCC(C)N1CC(C)CC(NCC2CCC2)C1
InChIInChI=1S/C15H30N2/c1-4-13(3)17-10-12(2)8-15(11-17)16-9-14-6-5-7-14/h12-16H,4-11H2,1-3H3
InChIKeyGUGGJFJOWMFCNU-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclobutylmethyl)-5-ethyl-1-propan-2-ylpiperidin-3-amine
CID 83997047
N-(cyclopentylmethyl)-5-methyl-1-(2-methylpropyl)piperidin-3-amine
CID 83997686
1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
CID 83997328
N-[(1-butan-2-ylpiperidin-3-yl)methyl]cyclopropanamine
CID 63849007
1-(1-cyclobutylpropyl)-N-ethyl-5-methylpiperidin-3-amine
CID 83990601
N-[(1-butan-2-ylpiperidin-4-yl)methyl]cyclopropanamine
CID 63848083
1-butan-2-yl-3-chloro-5-methylpiperidine
CID 130802847
1-[5-(cyclobutylmethylamino)-1-(3-methylcyclobutyl)piperidin-3-yl]propan-1-ol
CID 112541490
2-[5-(cyclohexylmethylamino)-1-propan-2-ylpiperidin-3-yl]ethanol
CID 83998440
3-(cyclobutylmethylamino)-5-methylpiperidine-1-carboxamide
CID 83997098
1-(1-cyclobutylethyl)-N-(2,2-dimethylpropyl)-5-methylpiperidin-3-amine
CID 83995335
1-butan-2-yl-N-methylazetidin-3-amine
CID 117002866

Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine?
The IUPAC name of 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine (CID 83997264) is 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine.
What is the SMILES notation for 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine?
The canonical SMILES for 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine is CCC(C)N1CC(C)CC(NCC2CCC2)C1.
What is the InChIKey of 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine?
The InChIKey is GUGGJFJOWMFCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-13(3)17-10-12(2)8-15(11-17)16-9-14-6-5-7-14/h12-16H,4-11H2,1-3H3.
What are the key properties of 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine?
1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine has a molecular weight of 238.42 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine is sourced from PubChem (CID 83997264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).