N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine

C16H32N2 — CID 79865475

IUPACN-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
SMILESCCNC1C(CN2CCCCC2C)CCC1(C)C
InChIInChI=1S/C16H32N2/c1-5-17-15-14(9-10-16(15,3)4)12-18-11-7-6-8-13(18)2/h13-15,17H,5-12H2,1-4H3
InChIKeyFZCIPOHRFPOBHJ-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds4

About N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine

N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine (PubChem CID 79865475) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
PubChem CID79865475
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC NameN-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
SMILESCCNC1C(CN2CCCCC2C)CCC1(C)C
InChIInChI=1S/C16H32N2/c1-5-17-15-14(9-10-16(15,3)4)12-18-11-7-6-8-13(18)2/h13-15,17H,5-12H2,1-4H3
InChIKeyFZCIPOHRFPOBHJ-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-[(2,4-dimethylpiperidin-1-yl)methyl]-N-ethyl-2,2-dimethylcyclohexan-1-amine
CID 79848332
5-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
CID 79865810
N-ethyl-2,2-dimethyl-5-[(2,3,5-trimethylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 114596778
5-[(2,5-dimethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79855959
2-[1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl]piperidin-2-yl]ethanol
CID 79866086
2,2-dimethyl-6-[(2-methylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 79852553
6-[(2-ethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79842434
5-[(7,7-dimethyl-1,4-thiazepan-4-yl)methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine
CID 107459384
N-ethyl-5-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-2,2-dimethylcyclopentan-1-amine
CID 79855421
1-[[2-(ethylamino)-3,3-dimethylcyclohexyl]methyl]-4-methylpiperidin-4-ol
CID 81116006
6-[(2,3-dimethylpiperidin-1-yl)methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79842625
N-ethyl-3-[(2-methylazepan-1-yl)methyl]oxan-4-amine
CID 103060277

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine?
The IUPAC name of N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine (CID 79865475) is N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine is CCNC1C(CN2CCCCC2C)CCC1(C)C.
What is the InChIKey of N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine?
The InChIKey is FZCIPOHRFPOBHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-5-17-15-14(9-10-16(15,3)4)12-18-11-7-6-8-13(18)2/h13-15,17H,5-12H2,1-4H3.
What are the key properties of N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine?
N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-dimethyl-5-[(2-methylpiperidin-1-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 79865475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).