3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine

C14H28N2 — CID 114547529

IUPAC3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine
SMILESCC1(C)CCC(NCC2(C)CCNCC2)C1
InChIInChI=1S/C14H28N2/c1-13(2)5-4-12(10-13)16-11-14(3)6-8-15-9-7-14/h12,15-16H,4-11H2,1-3H3
InChIKeyOKOPGTMPNMRLGN-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.54
Rot. Bonds3

About 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine

3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine (PubChem CID 114547529) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine
PubChem CID114547529
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine
SMILESCC1(C)CCC(NCC2(C)CCNCC2)C1
InChIInChI=1S/C14H28N2/c1-13(2)5-4-12(10-13)16-11-14(3)6-8-15-9-7-14/h12,15-16H,4-11H2,1-3H3
InChIKeyOKOPGTMPNMRLGN-UHFFFAOYSA-N
XLogP2.54
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine?
The IUPAC name of 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine (CID 114547529) is 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine is CC1(C)CCC(NCC2(C)CCNCC2)C1.
What is the InChIKey of 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine?
The InChIKey is OKOPGTMPNMRLGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-13(2)5-4-12(10-13)16-11-14(3)6-8-15-9-7-14/h12,15-16H,4-11H2,1-3H3.
What are the key properties of 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine?
3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-N-[(4-methylpiperidin-4-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 114547529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).