N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine

C15H30N2 — CID 64514748

IUPACN-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine
SMILESCC1CCC(N2CCCC(CNC(C)C)C2)C1
InChIInChI=1S/C15H30N2/c1-12(2)16-10-14-5-4-8-17(11-14)15-7-6-13(3)9-15/h12-16H,4-11H2,1-3H3
InChIKeyOYZYOVHGRFWPDY-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds4

About N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine

N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine (PubChem CID 64514748) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine
PubChem CID64514748
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine
SMILESCC1CCC(N2CCCC(CNC(C)C)C2)C1
InChIInChI=1S/C15H30N2/c1-12(2)16-10-14-5-4-8-17(11-14)15-7-6-13(3)9-15/h12-16H,4-11H2,1-3H3
InChIKeyOYZYOVHGRFWPDY-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine (CID 64514748) is N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine is CC1CCC(N2CCCC(CNC(C)C)C2)C1.
What is the InChIKey of N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine?
The InChIKey is OYZYOVHGRFWPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-12(2)16-10-14-5-4-8-17(11-14)15-7-6-13(3)9-15/h12-16H,4-11H2,1-3H3.
What are the key properties of N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine?
N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine has a molecular weight of 238.42 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-methylcyclopentyl)piperidin-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 64514748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).