N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine

C14H27NO — CID 62723961

IUPACN-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
SMILESCOCCC1(CNC(C)C)CC2CCC1C2
InChIInChI=1S/C14H27NO/c1-11(2)15-10-14(6-7-16-3)9-12-4-5-13(14)8-12/h11-13,15H,4-10H2,1-3H3
InChIKeyJGAJSWVOCCZVFT-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.83
Rot. Bonds6

About N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine

N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine (PubChem CID 62723961) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
PubChem CID62723961
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
SMILESCOCCC1(CNC(C)C)CC2CCC1C2
InChIInChI=1S/C14H27NO/c1-11(2)15-10-14(6-7-16-3)9-12-4-5-13(14)8-12/h11-13,15H,4-10H2,1-3H3
InChIKeyJGAJSWVOCCZVFT-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[2-(3-methylbutyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
CID 63522177
N-[(2-hexyl-2-bicyclo[2.2.1]heptanyl)methyl]propan-2-amine
CID 63522001
N-[[2-(cyclopentylmethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
CID 63521466
N-[[2-(4-methoxybutyl)-2-bicyclo[2.2.1]heptanyl]methyl]-2-methylpropan-1-amine
CID 104649309
N-[[2-(2,2,2-trifluoroethoxymethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
CID 106705985
2-methoxy-N-[[2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-bicyclo[2.2.1]heptanyl]methyl]ethanamine
CID 115943396
N-[(2-benzyl-2-bicyclo[2.2.1]heptanyl)methyl]propan-2-amine
CID 63521467
N-[[2-[2-(3-methoxypropoxy)ethyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-1-amine
CID 103183453
N-[[2-(2-propan-2-yloxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-1-amine
CID 62723558
N-[[2-[(4-fluorophenyl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
CID 63521648
N-[(2-cyclopentyl-2-bicyclo[2.2.1]heptanyl)methyl]propan-2-amine
CID 82933969
2-(chloromethyl)-2-(4-methoxybutyl)bicyclo[2.2.1]heptane
CID 104650647

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine?
The IUPAC name of N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine (CID 62723961) is N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine is COCCC1(CNC(C)C)CC2CCC1C2.
What is the InChIKey of N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine?
The InChIKey is JGAJSWVOCCZVFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-11(2)15-10-14(6-7-16-3)9-12-4-5-13(14)8-12/h11-13,15H,4-10H2,1-3H3.
What are the key properties of N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine?
N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine has a molecular weight of 225.38 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-methoxyethyl)-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine is sourced from PubChem (CID 62723961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).