(4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone

C15H28N2O — CID 120814044

IUPAC(4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone
SMILESCCC1(C(=O)N2CCC(N)C(C)(C)C2)CCCC1
InChIInChI=1S/C15H28N2O/c1-4-15(8-5-6-9-15)13(18)17-10-7-12(16)14(2,3)11-17/h12H,4-11,16H2,1-3H3
InChIKeyUZOPEGOUSLQWGT-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.54
Rot. Bonds2

About (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone

(4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone (PubChem CID 120814044) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone.

Molecular Properties

Compound Name(4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone
PubChem CID120814044
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name(4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone
SMILESCCC1(C(=O)N2CCC(N)C(C)(C)C2)CCCC1
InChIInChI=1S/C15H28N2O/c1-4-15(8-5-6-9-15)13(18)17-10-7-12(16)14(2,3)11-17/h12H,4-11,16H2,1-3H3
InChIKeyUZOPEGOUSLQWGT-UHFFFAOYSA-N
XLogP2.54
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-amino-3,3-dimethylpiperidin-1-yl)-(1-methylcyclopentyl)methanone
CID 120817727
(4-amino-3,3-dimethylpiperidin-1-yl)-[1-(3-bromophenyl)cyclopentyl]methanone
CID 120818548
(4-amino-3,3-dimethylpiperidin-1-yl)-cyclobutylmethanone;hydrochloride
CID 120818837
methyl 4-amino-3,3-dimethylpiperidine-1-carboxylate
CID 115269783
(4-amino-3,3-dimethylpiperidin-1-yl)-(7-bicyclo[4.1.0]heptanyl)methanone
CID 120820176
(1-ethylcyclopentyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 107224848
2-[1-(1-ethylcyclobutanecarbonyl)piperidin-4-yl]acetic acid
CID 119178068
3-[2-(4-amino-3,3-dimethylpiperidin-1-yl)-2-oxoethyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 120816912
1-(4-amino-3,3-dimethylpiperidin-1-yl)-2-(cyclopentylmethyl)butan-1-one
CID 120819076
(4-amino-3,3-dimethylpiperidin-1-yl)-[1-(3,5-dimethylphenyl)cyclopropyl]methanone;hydrochloride
CID 120816629
1-(4-amino-3,3-dimethylpiperidin-1-yl)-3,3-dimethylpentan-1-one;hydrochloride
CID 120819086
1-(4-amino-3,3-dimethylpiperidin-1-yl)-2-(2-methylcyclohexyl)oxyethanone
CID 120816436

Frequently Asked Questions

What is the IUPAC name of (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone?
The IUPAC name of (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone (CID 120814044) is (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone.
What is the SMILES notation for (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone?
The canonical SMILES for (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone is CCC1(C(=O)N2CCC(N)C(C)(C)C2)CCCC1.
What is the InChIKey of (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone?
The InChIKey is UZOPEGOUSLQWGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-4-15(8-5-6-9-15)13(18)17-10-7-12(16)14(2,3)11-17/h12H,4-11,16H2,1-3H3.
What are the key properties of (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone?
(4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone has a molecular weight of 252.40 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3,3-dimethylpiperidin-1-yl)-(1-ethylcyclopentyl)methanone is sourced from PubChem (CID 120814044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).