(2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine

C18H22N2 — CID 114604475

IUPAC(2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine
SMILESCCc1cccnc1C(N)c1ccccc1C1CCC1
InChIInChI=1S/C18H22N2/c1-2-13-9-6-12-20-18(13)17(19)16-11-4-3-10-15(16)14-7-5-8-14/h3-4,6,9-12,14,17H,2,5,7-8,19H2,1H3
InChIKeyGCVLNAMODSJGRA-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.96
Rot. Bonds4

About (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine

(2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine (PubChem CID 114604475) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine
PubChem CID114604475
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name(2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine
SMILESCCc1cccnc1C(N)c1ccccc1C1CCC1
InChIInChI=1S/C18H22N2/c1-2-13-9-6-12-20-18(13)17(19)16-11-4-3-10-15(16)14-7-5-8-14/h3-4,6,9-12,14,17H,2,5,7-8,19H2,1H3
InChIKeyGCVLNAMODSJGRA-UHFFFAOYSA-N
XLogP3.96
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 116506425
(2-ethoxyphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82729596
(2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82730897
[(3-chloro-2-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
CID 103445654
(2-cyclobutylphenyl)-pyridin-4-ylmethanamine
CID 114602569
[(4-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methyl]hydrazine
CID 105263897
(2-cyclobutylphenyl)-(4-propan-2-ylphenyl)methanamine
CID 114602556
(2-cyclobutylphenyl)-(4-methylphenyl)methanamine
CID 114602558
(2-cyclobutylphenyl)-(2,6-dimethyl-4-pyridinyl)methanamine
CID 107503001
(2-cyclobutylphenyl)-(1,3-thiazol-4-yl)methanamine
CID 114604148
(2,4-dimethoxyphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82729850
2-cyclobutyl-1-(3-ethyl-2-pyridinyl)-N-methylethanamine
CID 82729632

Frequently Asked Questions

What is the IUPAC name of (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine?
The IUPAC name of (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine (CID 114604475) is (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine.
What is the SMILES notation for (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine?
The canonical SMILES for (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine is CCc1cccnc1C(N)c1ccccc1C1CCC1.
What is the InChIKey of (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine?
The InChIKey is GCVLNAMODSJGRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-2-13-9-6-12-20-18(13)17(19)16-11-4-3-10-15(16)14-7-5-8-14/h3-4,6,9-12,14,17H,2,5,7-8,19H2,1H3.
What are the key properties of (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine?
(2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine has a molecular weight of 266.39 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine is sourced from PubChem (CID 114604475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).