N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine

C14H29N3 — CID 82767748

IUPACN-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine
SMILESCN1CCC(N(C)CC2(C)CCCC2N)CC1
InChIInChI=1S/C14H29N3/c1-14(8-4-5-13(14)15)11-17(3)12-6-9-16(2)10-7-12/h12-13H,4-11,15H2,1-3H3
InChIKeyREIYCXSYWMUJKT-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.53
Rot. Bonds3

About N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine

N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine (PubChem CID 82767748) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine
PubChem CID82767748
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine
SMILESCN1CCC(N(C)CC2(C)CCCC2N)CC1
InChIInChI=1S/C14H29N3/c1-14(8-4-5-13(14)15)11-17(3)12-6-9-16(2)10-7-12/h12-13H,4-11,15H2,1-3H3
InChIKeyREIYCXSYWMUJKT-UHFFFAOYSA-N
XLogP1.53
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine?
The IUPAC name of N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine (CID 82767748) is N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine.
What is the SMILES notation for N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine?
The canonical SMILES for N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine is CN1CCC(N(C)CC2(C)CCCC2N)CC1.
What is the InChIKey of N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine?
The InChIKey is REIYCXSYWMUJKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-14(8-4-5-13(14)15)11-17(3)12-6-9-16(2)10-7-12/h12-13H,4-11,15H2,1-3H3.
What are the key properties of N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine?
N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine has a molecular weight of 239.41 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-amino-1-methylcyclopentyl)methyl]-N,1-dimethylpiperidin-4-amine is sourced from PubChem (CID 82767748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).