N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine

C14H28N2 — CID 170412059

IUPACN,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine
SMILESCNC1(C)CC2CC(C)N(C(C)C)C(C2)C1
InChIInChI=1S/C14H28N2/c1-10(2)16-11(3)6-12-7-13(16)9-14(4,8-12)15-5/h10-13,15H,6-9H2,1-5H3
InChIKeyZFPXOLSPICXPFP-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds2

About N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine

N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine (PubChem CID 170412059) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine.

Molecular Properties

Compound NameN,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine
PubChem CID170412059
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine
SMILESCNC1(C)CC2CC(C)N(C(C)C)C(C2)C1
InChIInChI=1S/C14H28N2/c1-10(2)16-11(3)6-12-7-13(16)9-14(4,8-12)15-5/h10-13,15H,6-9H2,1-5H3
InChIKeyZFPXOLSPICXPFP-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-2-propan-2-yl-2-azabicyclo[3.2.2]nonane
CID 167181477
N,1,3-trimethylcyclobutan-1-amine
CID 146805170
(2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine
CID 58977160
(1R,3S,4S,5S,6S)-4-fluoro-2-propan-2-yl-2-azatricyclo[3.2.1.03,6]octan-5-amine
CID 170046907
3-methyl-6-propan-2-yl-6-azabicyclo[3.1.1]heptane
CID 147755667
1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine
CID 115305138
(2S,6R)-2,6-dimethyl-1-propan-2-yl-4-propan-2-yloxypiperidine
CID 154605097
ethane;3-methyl-6-propan-2-yl-6-azabicyclo[3.1.1]heptane
CID 166462217
N-methyladamantan-1-amine
CID 19476
(5R,7R)-3,3,7-trimethyl-1-azabicyclo[3.2.1]octane
CID 135189684
N-[1-(1-adamantyl)ethyl]-2,2,3,3-tetramethylcyclopropan-1-amine
CID 79352687
(3S)-N,3-dimethyl-1-propan-2-ylpyrrolidin-3-amine
CID 166707515

Frequently Asked Questions

What is the IUPAC name of N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine?
The IUPAC name of N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine (CID 170412059) is N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine.
What is the SMILES notation for N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine?
The canonical SMILES for N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine is CNC1(C)CC2CC(C)N(C(C)C)C(C2)C1.
What is the InChIKey of N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine?
The InChIKey is ZFPXOLSPICXPFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-10(2)16-11(3)6-12-7-13(16)9-14(4,8-12)15-5/h10-13,15H,6-9H2,1-5H3.
What are the key properties of N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine?
N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,7-trimethyl-2-propan-2-yl-2-azabicyclo[3.3.1]nonan-7-amine is sourced from PubChem (CID 170412059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).