1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine

C14H30N2 — CID 115707671

IUPAC1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine
SMILESCCCC(C)C(CC)NC1CCN(C)CC1
InChIInChI=1S/C14H30N2/c1-5-7-12(3)14(6-2)15-13-8-10-16(4)11-9-13/h12-15H,5-11H2,1-4H3
InChIKeyCJYMZYITPVIALZ-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.88
Rot. Bonds6

About 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine

1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine (PubChem CID 115707671) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine
PubChem CID115707671
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine
SMILESCCCC(C)C(CC)NC1CCN(C)CC1
InChIInChI=1S/C14H30N2/c1-5-7-12(3)14(6-2)15-13-8-10-16(4)11-9-13/h12-15H,5-11H2,1-4H3
InChIKeyCJYMZYITPVIALZ-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine?
The IUPAC name of 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine (CID 115707671) is 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine.
What is the SMILES notation for 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine?
The canonical SMILES for 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine is CCCC(C)C(CC)NC1CCN(C)CC1.
What is the InChIKey of 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine?
The InChIKey is CJYMZYITPVIALZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-7-12(3)14(6-2)15-13-8-10-16(4)11-9-13/h12-15H,5-11H2,1-4H3.
What are the key properties of 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine?
1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine has a molecular weight of 226.41 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(4-methylheptan-3-yl)piperidin-4-amine is sourced from PubChem (CID 115707671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).