(4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone

C11H20N2O — CID 79867706

IUPAC(4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone
SMILESCC1CN(C(=O)C2CCC2)CCC1N
InChIInChI=1S/C11H20N2O/c1-8-7-13(6-5-10(8)12)11(14)9-3-2-4-9/h8-10H,2-7,12H2,1H3
InChIKeyMXDVKDMSMQRKFJ-UHFFFAOYSA-N
MW196.29 g/mol
LogP0.98
Rot. Bonds1

About (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone

(4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone (PubChem CID 79867706) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone.

Molecular Properties

Compound Name(4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone
PubChem CID79867706
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name(4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone
SMILESCC1CN(C(=O)C2CCC2)CCC1N
InChIInChI=1S/C11H20N2O/c1-8-7-13(6-5-10(8)12)11(14)9-3-2-4-9/h8-10H,2-7,12H2,1H3
InChIKeyMXDVKDMSMQRKFJ-UHFFFAOYSA-N
XLogP0.98
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-amino-3-methylpiperidin-1-yl)-cycloheptylmethanone
CID 79868589
(4-amino-3-methylpiperidin-1-yl)-(1-methylpyrrolidin-3-yl)methanone
CID 79867793
cyclopropyl-(3,4-dimethylpiperidin-1-yl)methanone
CID 21061776
(3S,4S)-4-amino-3-methylpiperidine-1-carboxylic acid
CID 146402119
(4-amino-3-methylpiperidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 79879328
(3-chloro-4-methylpiperidin-1-yl)-cyclobutylmethanone
CID 102961823
1-(4-amino-3-methylpiperidin-1-yl)ethanone;hydrochloride
CID 71757060
(4-amino-3-methylpiperidin-1-yl)-(oxolan-2-yl)methanone;hydrochloride
CID 119260927
(4-chloro-3-methylpiperidin-1-yl)-cyclopropylmethanone
CID 114682955
(4-bromo-3-methylpiperidin-1-yl)-cyclopropylmethanone
CID 114683325
(3-amino-4-ethylpiperidin-1-yl)-cyclopentylmethanone
CID 165439908
(4-chloro-3-methylpiperidin-1-yl)-cyclooctylmethanone
CID 114683217

Frequently Asked Questions

What is the IUPAC name of (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone?
The IUPAC name of (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone (CID 79867706) is (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone.
What is the SMILES notation for (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone?
The canonical SMILES for (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone is CC1CN(C(=O)C2CCC2)CCC1N.
What is the InChIKey of (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone?
The InChIKey is MXDVKDMSMQRKFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-8-7-13(6-5-10(8)12)11(14)9-3-2-4-9/h8-10H,2-7,12H2,1H3.
What are the key properties of (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone?
(4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone has a molecular weight of 196.29 g/mol, XLogP of 0.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3-methylpiperidin-1-yl)-cyclobutylmethanone is sourced from PubChem (CID 79867706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).