N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine

C15H28N2 — CID 79715371

IUPACN-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine
SMILESCC1CCCC1N(CC1CCNCC1)C1CC1
InChIInChI=1S/C15H28N2/c1-12-3-2-4-15(12)17(14-5-6-14)11-13-7-9-16-10-8-13/h12-16H,2-11H2,1H3
InChIKeyMYJYLLIFCJFTDY-UHFFFAOYSA-N
MW236.40 g/mol
LogP2.64
Rot. Bonds4

About N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine

N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine (PubChem CID 79715371) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine
PubChem CID79715371
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC NameN-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine
SMILESCC1CCCC1N(CC1CCNCC1)C1CC1
InChIInChI=1S/C15H28N2/c1-12-3-2-4-15(12)17(14-5-6-14)11-13-7-9-16-10-8-13/h12-16H,2-11H2,1H3
InChIKeyMYJYLLIFCJFTDY-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine?
The IUPAC name of N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine (CID 79715371) is N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine is CC1CCCC1N(CC1CCNCC1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine?
The InChIKey is MYJYLLIFCJFTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-12-3-2-4-15(12)17(14-5-6-14)11-13-7-9-16-10-8-13/h12-16H,2-11H2,1H3.
What are the key properties of N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine?
N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine has a molecular weight of 236.40 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-methyl-N-(piperidin-4-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 79715371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).