N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine

C15H30N2 — CID 79866936

IUPACN,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
SMILESCNC1C(CN2CCCC(C)C2)CCC1(C)C
InChIInChI=1S/C15H30N2/c1-12-6-5-9-17(10-12)11-13-7-8-15(2,3)14(13)16-4/h12-14,16H,5-11H2,1-4H3
InChIKeyMFCSQFOEYNHDBO-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.74
Rot. Bonds3

About N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine

N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine (PubChem CID 79866936) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
PubChem CID79866936
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine
SMILESCNC1C(CN2CCCC(C)C2)CCC1(C)C
InChIInChI=1S/C15H30N2/c1-12-6-5-9-17(10-12)11-13-7-8-15(2,3)14(13)16-4/h12-14,16H,5-11H2,1-4H3
InChIKeyMFCSQFOEYNHDBO-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine?
The IUPAC name of N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine (CID 79866936) is N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine is CNC1C(CN2CCCC(C)C2)CCC1(C)C.
What is the InChIKey of N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine?
The InChIKey is MFCSQFOEYNHDBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-12-6-5-9-17(10-12)11-13-7-8-15(2,3)14(13)16-4/h12-14,16H,5-11H2,1-4H3.
What are the key properties of N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine?
N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-5-[(3-methylpiperidin-1-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 79866936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).