N-methyl-N,1-di(propan-2-yl)piperidin-3-amine

C12H26N2 — CID 159984005

IUPACN-methyl-N,1-di(propan-2-yl)piperidin-3-amine
SMILESCC(C)N1CCCC(N(C)C(C)C)C1
InChIInChI=1S/C12H26N2/c1-10(2)13(5)12-7-6-8-14(9-12)11(3)4/h10-12H,6-9H2,1-5H3
InChIKeyAYQWIZSKJYDDAH-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.20
Rot. Bonds3

About N-methyl-N,1-di(propan-2-yl)piperidin-3-amine

N-methyl-N,1-di(propan-2-yl)piperidin-3-amine (PubChem CID 159984005) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N-methyl-N,1-di(propan-2-yl)piperidin-3-amine.

Molecular Properties

Compound NameN-methyl-N,1-di(propan-2-yl)piperidin-3-amine
PubChem CID159984005
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN-methyl-N,1-di(propan-2-yl)piperidin-3-amine
SMILESCC(C)N1CCCC(N(C)C(C)C)C1
InChIInChI=1S/C12H26N2/c1-10(2)13(5)12-7-6-8-14(9-12)11(3)4/h10-12H,6-9H2,1-5H3
InChIKeyAYQWIZSKJYDDAH-UHFFFAOYSA-N
XLogP2.20
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N,1-di(propan-2-yl)piperidin-3-amine?
The IUPAC name of N-methyl-N,1-di(propan-2-yl)piperidin-3-amine (CID 159984005) is N-methyl-N,1-di(propan-2-yl)piperidin-3-amine.
What is the SMILES notation for N-methyl-N,1-di(propan-2-yl)piperidin-3-amine?
The canonical SMILES for N-methyl-N,1-di(propan-2-yl)piperidin-3-amine is CC(C)N1CCCC(N(C)C(C)C)C1.
What is the InChIKey of N-methyl-N,1-di(propan-2-yl)piperidin-3-amine?
The InChIKey is AYQWIZSKJYDDAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-10(2)13(5)12-7-6-8-14(9-12)11(3)4/h10-12H,6-9H2,1-5H3.
What are the key properties of N-methyl-N,1-di(propan-2-yl)piperidin-3-amine?
N-methyl-N,1-di(propan-2-yl)piperidin-3-amine has a molecular weight of 198.35 g/mol, XLogP of 2.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N,1-di(propan-2-yl)piperidin-3-amine is sourced from PubChem (CID 159984005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).