N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine

C19H23NO — CID 63682945

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine
SMILESc1ccc(C(NCC2CC3CCC2C3)c2ccco2)cc1
InChIInChI=1S/C19H23NO/c1-2-5-15(6-3-1)19(18-7-4-10-21-18)20-13-17-12-14-8-9-16(17)11-14/h1-7,10,14,16-17,19-20H,8-9,11-13H2
InChIKeyCNXWMFMUJUNJJP-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.39
Rot. Bonds5

About N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine

N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine (PubChem CID 63682945) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine
PubChem CID63682945
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine
SMILESc1ccc(C(NCC2CC3CCC2C3)c2ccco2)cc1
InChIInChI=1S/C19H23NO/c1-2-5-15(6-3-1)19(18-7-4-10-21-18)20-13-17-12-14-8-9-16(17)11-14/h1-7,10,14,16-17,19-20H,8-9,11-13H2
InChIKeyCNXWMFMUJUNJJP-UHFFFAOYSA-N
XLogP4.39
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bicyclo[2.2.1]heptanylmethyl)-1,1-dithiophen-2-ylmethanamine
CID 63689796
2-(2-bicyclo[2.2.1]heptanylmethylamino)-1-phenylethanol
CID 63681601
2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide
CID 55232631
3-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-phenylpropanamide;hydrochloride
CID 119950772
N-[3-(2-bicyclo[2.2.1]heptanyl)-2-phenylpropyl]cyclopropanamine
CID 79561966
1-(2-bicyclo[2.2.1]heptanyl)-3-phenylbutan-2-ol
CID 79557822
1-N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-N-methylbutane-1,2-diamine
CID 63688288
[2-(benzhydrylamino)-2-oxoethyl] 2-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]acetate
CID 2352480
(2S)-N-cyclopropyl-2-[[(S)-furan-2-yl(phenyl)methyl]amino]-2-phenylacetamide
CID 8756132
N-[furan-2-yl(phenyl)methyl]-2-morpholin-4-ylethanamine
CID 43178931
1-cyclobutyl-N-[furan-2-yl(phenyl)methyl]propan-2-amine
CID 115707858
N-(2-bicyclo[2.2.1]heptanylmethyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 64830997

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine (CID 63682945) is N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine is c1ccc(C(NCC2CC3CCC2C3)c2ccco2)cc1.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine?
The InChIKey is CNXWMFMUJUNJJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-5-15(6-3-1)19(18-7-4-10-21-18)20-13-17-12-14-8-9-16(17)11-14/h1-7,10,14,16-17,19-20H,8-9,11-13H2.
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine?
N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine has a molecular weight of 281.40 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(furan-2-yl)-1-phenylmethanamine is sourced from PubChem (CID 63682945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).