5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane

C10H19N — CID 130224407

IUPAC5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane
SMILESCC1CC2CC1CN2C(C)C
InChIInChI=1S/C10H19N/c1-7(2)11-6-9-5-10(11)4-8(9)3/h7-10H,4-6H2,1-3H3
InChIKeyUMHLAIZDRSVIAA-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.13
Rot. Bonds1

About 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane

5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane (PubChem CID 130224407) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane.

Molecular Properties

Compound Name5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane
PubChem CID130224407
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane
SMILESCC1CC2CC1CN2C(C)C
InChIInChI=1S/C10H19N/c1-7(2)11-6-9-5-10(11)4-8(9)3/h7-10H,4-6H2,1-3H3
InChIKeyUMHLAIZDRSVIAA-UHFFFAOYSA-N
XLogP2.13
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane?
The IUPAC name of 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane (CID 130224407) is 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane.
What is the SMILES notation for 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane?
The canonical SMILES for 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane is CC1CC2CC1CN2C(C)C.
What is the InChIKey of 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane?
The InChIKey is UMHLAIZDRSVIAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-7(2)11-6-9-5-10(11)4-8(9)3/h7-10H,4-6H2,1-3H3.
What are the key properties of 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane?
5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane has a molecular weight of 153.27 g/mol, XLogP of 2.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptane is sourced from PubChem (CID 130224407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).