(1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine

C16H20N2 — CID 81401879

IUPAC(1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine
SMILESCCc1ccccc1CN[C@H](C)c1ccccn1
InChIInChI=1S/C16H20N2/c1-3-14-8-4-5-9-15(14)12-18-13(2)16-10-6-7-11-17-16/h4-11,13,18H,3,12H2,1-2H3/t13-/m1/s1
InChIKeyBEAVFQIKVFAJKP-CYBMUJFWSA-N
MW240.35 g/mol
LogP3.49
Rot. Bonds5

About (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine

(1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine (PubChem CID 81401879) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine.

Molecular Properties

Compound Name(1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine
PubChem CID81401879
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name(1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine
SMILESCCc1ccccc1CN[C@H](C)c1ccccn1
InChIInChI=1S/C16H20N2/c1-3-14-8-4-5-9-15(14)12-18-13(2)16-10-6-7-11-17-16/h4-11,13,18H,3,12H2,1-2H3/t13-/m1/s1
InChIKeyBEAVFQIKVFAJKP-CYBMUJFWSA-N
XLogP3.49
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-pyridin-2-yl-N-(pyrimidin-2-ylmethyl)ethanamine
CID 81407076
(1R)-N-[(2-phenylphenyl)methyl]-1-pyridin-2-ylethanamine
CID 69062118
N-[(2-nitrophenyl)methyl]-1-pyridin-2-ylethanamine
CID 43181334
(1R)-N-[(2-nitrophenyl)methyl]-1-pyridin-2-ylethanamine
CID 28648797
2-[[[(1R)-1-pyridin-2-ylethyl]amino]methyl]benzonitrile
CID 93034581
(1R)-N-[(3-chloro-2-fluorophenyl)methyl]-1-pyridin-2-ylethanamine
CID 104930267
(1S)-1-pyridin-2-yl-N-[(2-pyrrolidin-1-ylphenyl)methyl]ethanamine
CID 78979013
N-[(2-methyl-3-nitrophenyl)methyl]-1-pyridin-2-ylethanamine
CID 43524371
(1R)-N-[(2-prop-2-ynoxyphenyl)methyl]-1-pyridin-2-ylethanamine
CID 28648846
(1S)-N-(1H-indol-3-ylmethyl)-1-pyridin-2-ylethanamine
CID 81401542
(1R)-N-[(4-chloro-2-methylphenyl)methyl]-1-pyridin-2-ylethanamine
CID 104868538
2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]butan-1-amine
CID 28647872

Frequently Asked Questions

What is the IUPAC name of (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine?
The IUPAC name of (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine (CID 81401879) is (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine.
What is the SMILES notation for (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine?
The canonical SMILES for (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine is CCc1ccccc1CN[C@H](C)c1ccccn1.
What is the InChIKey of (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine?
The InChIKey is BEAVFQIKVFAJKP-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H20N2/c1-3-14-8-4-5-9-15(14)12-18-13(2)16-10-6-7-11-17-16/h4-11,13,18H,3,12H2,1-2H3/t13-/m1/s1.
What are the key properties of (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine?
(1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine has a molecular weight of 240.35 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[(2-ethylphenyl)methyl]-1-pyridin-2-ylethanamine is sourced from PubChem (CID 81401879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).