N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide

C15H29N3O — CID 65470299

IUPACN-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)CNC1CC2CCCC(C1)N2C
InChIInChI=1S/C15H29N3O/c1-11(2)17(3)15(19)10-16-12-8-13-6-5-7-14(9-12)18(13)4/h11-14,16H,5-10H2,1-4H3
InChIKeyMCQWPWBYODCFGG-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.46
Rot. Bonds4

About N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide

N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide (PubChem CID 65470299) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide
PubChem CID65470299
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)CNC1CC2CCCC(C1)N2C
InChIInChI=1S/C15H29N3O/c1-11(2)17(3)15(19)10-16-12-8-13-6-5-7-14(9-12)18(13)4/h11-14,16H,5-10H2,1-4H3
InChIKeyMCQWPWBYODCFGG-UHFFFAOYSA-N
XLogP1.46
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide?
The IUPAC name of N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide (CID 65470299) is N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide is CC(C)N(C)C(=O)CNC1CC2CCCC(C1)N2C.
What is the InChIKey of N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide?
The InChIKey is MCQWPWBYODCFGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-11(2)17(3)15(19)10-16-12-8-13-6-5-7-14(9-12)18(13)4/h11-14,16H,5-10H2,1-4H3.
What are the key properties of N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide?
N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide has a molecular weight of 267.42 g/mol, XLogP of 1.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 65470299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).